N-(cyclopentylmethyl)quinazolin-2-amine

C14H17N3 — CID 114788866

IUPACN-(cyclopentylmethyl)quinazolin-2-amine
SMILESc1ccc2nc(NCC3CCCC3)ncc2c1
InChIInChI=1S/C14H17N3/c1-2-6-11(5-1)9-15-14-16-10-12-7-3-4-8-13(12)17-14/h3-4,7-8,10-11H,1-2,5-6,9H2,(H,15,16,17)
InChIKeyCULFGRWUYZXPGT-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.23
Rot. Bonds3

About N-(cyclopentylmethyl)quinazolin-2-amine

N-(cyclopentylmethyl)quinazolin-2-amine (PubChem CID 114788866) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(cyclopentylmethyl)quinazolin-2-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)quinazolin-2-amine
PubChem CID114788866
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-(cyclopentylmethyl)quinazolin-2-amine
SMILESc1ccc2nc(NCC3CCCC3)ncc2c1
InChIInChI=1S/C14H17N3/c1-2-6-11(5-1)9-15-14-16-10-12-7-3-4-8-13(12)17-14/h3-4,7-8,10-11H,1-2,5-6,9H2,(H,15,16,17)
InChIKeyCULFGRWUYZXPGT-UHFFFAOYSA-N
XLogP3.23
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxan-3-ylmethyl)quinazolin-2-amine
CID 114788931
N-(2-cyclobutylethyl)quinazolin-2-amine
CID 114789293
N-[(2-methylcyclopentyl)methyl]quinazolin-2-amine
CID 107419181
N-[2-(3-methylcyclohexyl)ethyl]quinazolin-2-amine
CID 114789119
N'-quinazolin-2-ylethane-1,2-diamine
CID 114788771
N-(cyclopentylmethyl)pyrimidin-2-amine
CID 43317116
N-(thian-3-yl)quinazolin-2-amine
CID 114789314
4-[(quinazolin-2-ylamino)methyl]phenol
CID 114789330
4-N-(cyclopentylmethyl)-2-N-methylquinazoline-2,4-diamine
CID 80783719
N-(3-butoxypropyl)quinazolin-2-amine
CID 114789297
N-[(4-aminophenyl)methyl]quinazolin-2-amine
CID 114789553
1-(quinazolin-2-ylamino)propan-2-ol
CID 114788870

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)quinazolin-2-amine?
The IUPAC name of N-(cyclopentylmethyl)quinazolin-2-amine (CID 114788866) is N-(cyclopentylmethyl)quinazolin-2-amine.
What is the SMILES notation for N-(cyclopentylmethyl)quinazolin-2-amine?
The canonical SMILES for N-(cyclopentylmethyl)quinazolin-2-amine is c1ccc2nc(NCC3CCCC3)ncc2c1.
What is the InChIKey of N-(cyclopentylmethyl)quinazolin-2-amine?
The InChIKey is CULFGRWUYZXPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-2-6-11(5-1)9-15-14-16-10-12-7-3-4-8-13(12)17-14/h3-4,7-8,10-11H,1-2,5-6,9H2,(H,15,16,17).
What are the key properties of N-(cyclopentylmethyl)quinazolin-2-amine?
N-(cyclopentylmethyl)quinazolin-2-amine has a molecular weight of 227.31 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)quinazolin-2-amine is sourced from PubChem (CID 114788866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).