N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide

C17H19N9O2 — CID 59313686

IUPACN-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide
SMILESO=C1NCCN1C(=O)NCc1nc(Nc2cc(C3CC3)[nH]n2)c2cccn2n1
InChIInChI=1S/C17H19N9O2/c27-16-18-5-7-25(16)17(28)19-9-14-21-15(12-2-1-6-26(12)24-14)20-13-8-11(22-23-13)10-3-4-10/h1-2,6,8,10H,3-5,7,9H2,(H,18,27)(H,19,28)(H2,20,21,22,23,24)
InChIKeyGEKMPDJKSPPIMO-UHFFFAOYSA-N
MW381.40 g/mol
LogP1.31
Rot. Bonds5

About N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide

N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide (PubChem CID 59313686) has the molecular formula C17H19N9O2 and a molecular weight of 381.40 g/mol. Its IUPAC name is N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide
PubChem CID59313686
Molecular FormulaC17H19N9O2
Molecular Weight381.40 g/mol
Exact Mass381.17
IUPAC NameN-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide
SMILESO=C1NCCN1C(=O)NCc1nc(Nc2cc(C3CC3)[nH]n2)c2cccn2n1
InChIInChI=1S/C17H19N9O2/c27-16-18-5-7-25(16)17(28)19-9-14-21-15(12-2-1-6-26(12)24-14)20-13-8-11(22-23-13)10-3-4-10/h1-2,6,8,10H,3-5,7,9H2,(H,18,27)(H,19,28)(H2,20,21,22,23,24)
InChIKeyGEKMPDJKSPPIMO-UHFFFAOYSA-N
XLogP1.31
TPSA132.34 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.40
LogP ≤ 51.31
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyrrolidin-1-ylpyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 58095931
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-ethylpyrrolo[2,1-f][1,2,4]triazine-2,4-diamine
CID 143606522
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-methylpyrrolidin-1-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 78030389
2-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino]-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]acetamide
CID 69063992
2-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-N-pyrazin-2-ylcyclopentene-1-carboxamide
CID 59313683
5-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-4-methyl-2-oxa-5-azabicyclo[2.2.0]hexan-3-one
CID 89150058
N-[1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]piperidin-4-yl]-3-piperidin-1-ylpropanamide
CID 68841525
1-[(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]pyrrolidin-2-yl]-2-(oxan-4-yl)ethanone
CID 58277599
1-[[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]butan-2-ol
CID 67318282
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-(2-pyridin-3-ylethyl)pyrrolo[2,1-f][1,2,4]triazine-2,4-diamine
CID 69067636
1-[(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-2-methylpyrrolidin-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanone
CID 161379547
1-[(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-2-methylpyrrolidin-2-yl]-2-piperidin-3-ylethanone
CID 58277678

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide (CID 59313686) is N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide is O=C1NCCN1C(=O)NCc1nc(Nc2cc(C3CC3)[nH]n2)c2cccn2n1.
What is the InChIKey of N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide?
The InChIKey is GEKMPDJKSPPIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N9O2/c27-16-18-5-7-25(16)17(28)19-9-14-21-15(12-2-1-6-26(12)24-14)20-13-8-11(22-23-13)10-3-4-10/h1-2,6,8,10H,3-5,7,9H2,(H,18,27)(H,19,28)(H2,20,21,22,23,24).
What are the key properties of N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide?
N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide has a molecular weight of 381.40 g/mol, XLogP of 1.31, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]methyl]-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 59313686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).