N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide

C17H21N5O2 — CID 77089366

IUPACN-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCCN(Cc1ccc(C)o1)C(=O)c1cc(C(C)C)n2ncnc2n1
InChIInChI=1S/C17H21N5O2/c1-5-21(9-13-7-6-12(4)24-13)16(23)14-8-15(11(2)3)22-17(20-14)18-10-19-22/h6-8,10-11H,5,9H2,1-4H3
InChIKeyJVOGJBXVDHPSFI-UHFFFAOYSA-N
MW327.39 g/mol
LogP2.81
Rot. Bonds5

About N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide

N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 77089366) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID77089366
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC NameN-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCCN(Cc1ccc(C)o1)C(=O)c1cc(C(C)C)n2ncnc2n1
InChIInChI=1S/C17H21N5O2/c1-5-21(9-13-7-6-12(4)24-13)16(23)14-8-15(11(2)3)22-17(20-14)18-10-19-22/h6-8,10-11H,5,9H2,1-4H3
InChIKeyJVOGJBXVDHPSFI-UHFFFAOYSA-N
XLogP2.81
TPSA76.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-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-methyl-7-propan-2-yl-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 72928173
N-[2-(furan-2-ylmethyl)-3-hydroxypropyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 77080556
(2S)-N-ethyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 95128950
N-ethyl-1-methyl-N-[(5-methylfuran-2-yl)methyl]-3-propylpyrazole-5-carboxamide
CID 70736847
N-[(2-phenyl-1,3-oxazol-4-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 72860317
[(2S)-2-butyl-2,5-dihydropyrrol-1-yl]-(7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methanone
CID 95550344
N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 131916690
3-[ethyl-[methyl-[(5-methylfuran-2-yl)methyl]carbamoyl]amino]-2-methylpropanoic acid
CID 62852289
N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 51592806
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 72873815
N-[2-[benzyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-N-propan-2-ylnaphthalene-2-carboxamide
CID 3686088
2-[butan-2-yl-[(5-methylfuran-2-yl)methyl]amino]acetic acid
CID 60833890

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide (CID 77089366) is N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide is CCN(Cc1ccc(C)o1)C(=O)c1cc(C(C)C)n2ncnc2n1.
What is the InChIKey of N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is JVOGJBXVDHPSFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O2/c1-5-21(9-13-7-6-12(4)24-13)16(23)14-8-15(11(2)3)22-17(20-14)18-10-19-22/h6-8,10-11H,5,9H2,1-4H3.
What are the key properties of N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide?
N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 327.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(5-methylfuran-2-yl)methyl]-7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 77089366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).