N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine

C16H15N5 — CID 178038423

IUPACN-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine
SMILESc1ccc2c(c1)CC(Nc1ncc(-c3cn[nH]c3)cn1)C2
InChIInChI=1S/C16H15N5/c1-2-4-12-6-15(5-11(12)3-1)21-16-17-7-13(8-18-16)14-9-19-20-10-14/h1-4,7-10,15H,5-6H2,(H,19,20)(H,17,18,21)
InChIKeyCDAKIKWSUFAMCP-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.45
Rot. Bonds3

About N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine

N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine (PubChem CID 178038423) has the molecular formula C16H15N5 and a molecular weight of 277.33 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine
PubChem CID178038423
Molecular FormulaC16H15N5
Molecular Weight277.33 g/mol
Exact Mass277.13
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine
SMILESc1ccc2c(c1)CC(Nc1ncc(-c3cn[nH]c3)cn1)C2
InChIInChI=1S/C16H15N5/c1-2-4-12-6-15(5-11(12)3-1)21-16-17-7-13(8-18-16)14-9-19-20-10-14/h1-4,7-10,15H,5-6H2,(H,19,20)(H,17,18,21)
InChIKeyCDAKIKWSUFAMCP-UHFFFAOYSA-N
XLogP2.45
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine 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

[5-[2-(2,3-dihydro-1H-inden-2-ylamino)pyrimidin-5-yl]-1,3,4-oxadiazol-2-yl] cyclopropanecarboxylate
CID 175289369
2-(2,3-dihydro-1H-inden-2-ylamino)-N-[4-(2H-triazol-4-yl)butyl]pyrimidine-5-carboxamide
CID 162717362
(5S)-N-[(1S)-1-[4-[2-(2,3-dihydro-1H-inden-2-ylamino)pyrimidin-5-yl]phenyl]ethyl]-4,5,6,7-tetrahydro-2H-benzotriazole-5-carboxamide
CID 170962370
N-(2,3-dihydro-1H-inden-2-yl)-5-fluoro-4-methoxypyrimidin-2-amine
CID 135097043
4-(1H-pyrazol-4-yl)-1H-pyrazole
CID 2422340
N-(2,3-dihydro-1H-inden-2-yl)-6-[2-(2H-triazol-4-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine
CID 90281607
N-[3-[2-(2,3-dihydro-1H-inden-2-ylamino)pyrimidin-5-yl]phenyl]-2,4,6,7-tetrahydrotriazolo[4,5-c]pyridine-5-carboxamide
CID 171108061
4-N-(2,3-dihydro-1H-inden-2-yl)-5-fluoro-2-N-methylpyrimidine-2,4-diamine
CID 107855407
tert-butyl 4-[2-(2,3-dihydro-1H-inden-2-ylamino)pyrimidin-5-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
CID 142740284
(5S)-N-[3-[2-(2,3-dihydro-1H-inden-2-ylamino)pyrimidin-5-yl]-5-propan-2-yloxyphenyl]-4,5,6,7-tetrahydro-2H-benzotriazole-5-carboxamide
CID 170962441
(3S)-N-[4-(1H-pyrazol-4-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 117075909
2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 107855436

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine (CID 178038423) is N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine is c1ccc2c(c1)CC(Nc1ncc(-c3cn[nH]c3)cn1)C2.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine?
The InChIKey is CDAKIKWSUFAMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5/c1-2-4-12-6-15(5-11(12)3-1)21-16-17-7-13(8-18-16)14-9-19-20-10-14/h1-4,7-10,15H,5-6H2,(H,19,20)(H,17,18,21).
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine?
N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine has a molecular weight of 277.33 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-5-(1H-pyrazol-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 178038423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).