N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C22H23N5 — CID 166324418

IUPACN-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESNCc1ccc2c(c1)CCC2Nc1nc(-c2ccccn2)nc2c1CCC2
InChIInChI=1S/C22H23N5/c23-13-14-7-9-16-15(12-14)8-10-19(16)25-21-17-4-3-6-18(17)26-22(27-21)20-5-1-2-11-24-20/h1-2,5,7,9,11-12,19H,3-4,6,8,10,13,23H2,(H,25,26,27)
InChIKeyDFUWWVCOUKOIAN-UHFFFAOYSA-N
MW357.46 g/mol
LogP3.59
Rot. Bonds4

About N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 166324418) has the molecular formula C22H23N5 and a molecular weight of 357.46 g/mol. Its IUPAC name is N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID166324418
Molecular FormulaC22H23N5
Molecular Weight357.46 g/mol
Exact Mass357.20
IUPAC NameN-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESNCc1ccc2c(c1)CCC2Nc1nc(-c2ccccn2)nc2c1CCC2
InChIInChI=1S/C22H23N5/c23-13-14-7-9-16-15(12-14)8-10-19(16)25-21-17-4-3-6-18(17)26-22(27-21)20-5-1-2-11-24-20/h1-2,5,7,9,11-12,19H,3-4,6,8,10,13,23H2,(H,25,26,27)
InChIKeyDFUWWVCOUKOIAN-UHFFFAOYSA-N
XLogP3.59
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine with MolForge

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Related Compounds

N-ethyl-2-pyridin-2-yl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63351510
N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 157371099
2-[[(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 133324076
2-methyl-2-[[(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 133344011
4-[(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]butanoic acid
CID 122058595
N-[2-(3,4-difluorophenyl)oxolan-3-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133435175
N-[(2R,3S)-1-methyl-2-phenylpyrrolidin-3-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 124840393
1-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-1,2,3,4-tetrahydronaphthalene-1,6-diamine
CID 116650402
N-[4-(4-methylpiperazin-1-yl)butan-2-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133480741
2-pyridin-2-yl-N-[2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133415436
3-methoxy-1-[4-[(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]piperidin-1-yl]propan-1-one
CID 133377520
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133466669

Frequently Asked Questions

What is the IUPAC name of N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 166324418) is N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is NCc1ccc2c(c1)CCC2Nc1nc(-c2ccccn2)nc2c1CCC2.
What is the InChIKey of N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is DFUWWVCOUKOIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5/c23-13-14-7-9-16-15(12-14)8-10-19(16)25-21-17-4-3-6-18(17)26-22(27-21)20-5-1-2-11-24-20/h1-2,5,7,9,11-12,19H,3-4,6,8,10,13,23H2,(H,25,26,27).
What are the key properties of N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 357.46 g/mol, XLogP of 3.59, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 166324418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).