N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine

C10H15ClN4 — CID 105370016

IUPACN-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine
SMILESNCC1CCCC1Nc1ncncc1Cl
InChIInChI=1S/C10H15ClN4/c11-8-5-13-6-14-10(8)15-9-3-1-2-7(9)4-12/h5-7,9H,1-4,12H2,(H,13,14,15)
InChIKeySLJUNXXWQOYUDB-UHFFFAOYSA-N
MW226.71 g/mol
LogP1.67
Rot. Bonds3

About N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine

N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine (PubChem CID 105370016) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine
PubChem CID105370016
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine
SMILESNCC1CCCC1Nc1ncncc1Cl
InChIInChI=1S/C10H15ClN4/c11-8-5-13-6-14-10(8)15-9-3-1-2-7(9)4-12/h5-7,9H,1-4,12H2,(H,13,14,15)
InChIKeySLJUNXXWQOYUDB-UHFFFAOYSA-N
XLogP1.67
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[(1R,2S)-2-fluorocyclopentyl]pyrimidin-4-amine
CID 126987815
2-[(5-chloropyrimidin-4-yl)amino]cyclohexan-1-ol
CID 105369367
N-[2-(aminomethyl)cyclohexyl]-5-chloro-3-fluoropyridin-2-amine
CID 79727754
[2-[(5-iodopyrimidin-4-yl)amino]cyclopentyl]methanol
CID 106361969
5-chloro-N-[(2-methylcyclohexyl)methyl]pyrimidin-4-amine
CID 105369322
5-chloro-N-(3-methylcyclohexyl)pyrimidin-4-amine
CID 105369162
5-bromo-3-chloro-N-[2-(chloromethyl)cyclopentyl]pyridin-2-amine
CID 106365408
N-(2-ethylcyclohexyl)-5-iodopyrimidin-4-amine
CID 66343239
5-chloro-N-cyclopent-3-en-1-ylpyrimidin-4-amine
CID 105369623
N-(5-chloropyrimidin-4-yl)-1-cyclopropylethane-1,2-diamine
CID 105370003
N'-(5-chloropyrimidin-4-yl)-N-cycloheptylethane-1,2-diamine
CID 105370083
N-[2-(aminomethyl)cyclohexyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686896

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine (CID 105370016) is N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine is NCC1CCCC1Nc1ncncc1Cl.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine?
The InChIKey is SLJUNXXWQOYUDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c11-8-5-13-6-14-10(8)15-9-3-1-2-7(9)4-12/h5-7,9H,1-4,12H2,(H,13,14,15).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine?
N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine has a molecular weight of 226.71 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-5-chloropyrimidin-4-amine is sourced from PubChem (CID 105370016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).