4-cyclopentylpyrimidine-2,5-diamine

C9H14N4 — CID 82409896

IUPAC4-cyclopentylpyrimidine-2,5-diamine
SMILESNc1ncc(N)c(C2CCCC2)n1
InChIInChI=1S/C9H14N4/c10-7-5-12-9(11)13-8(7)6-3-1-2-4-6/h5-6H,1-4,10H2,(H2,11,12,13)
InChIKeyPKPHTSNSDABBSF-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.30
Rot. Bonds1

About 4-cyclopentylpyrimidine-2,5-diamine

4-cyclopentylpyrimidine-2,5-diamine (PubChem CID 82409896) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 4-cyclopentylpyrimidine-2,5-diamine.

Molecular Properties

Compound Name4-cyclopentylpyrimidine-2,5-diamine
PubChem CID82409896
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name4-cyclopentylpyrimidine-2,5-diamine
SMILESNc1ncc(N)c(C2CCCC2)n1
InChIInChI=1S/C9H14N4/c10-7-5-12-9(11)13-8(7)6-3-1-2-4-6/h5-6H,1-4,10H2,(H2,11,12,13)
InChIKeyPKPHTSNSDABBSF-UHFFFAOYSA-N
XLogP1.30
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopentyl-5-fluoropyrimidin-2-amine
CID 171659947
2-(cyclopentylsulfanylmethyl)-4-cyclopropylpyrimidin-5-amine
CID 114207246
5-cyclohexylpyrimidine-2,4-diamine
CID 23086329
4-cyclopropyl-2-(2-methylpropyl)pyrimidin-5-amine
CID 130483729
6-cyclopentyl-5-fluoropyrimidine-2,4-diamine
CID 67519663
5,8-dimethyl-5,6,7,8-tetrahydroquinazolin-2-amine
CID 64760327
4-cyclohexyl-5-[3-(trifluoromethoxy)phenyl]pyrimidin-2-amine
CID 68632642
5-(aminomethyl)-2-cyclohexylpyridin-3-amine
CID 105458264
4-cyclohexylquinazolin-2-amine
CID 66520631
4-cyclopropyl-5-(4-methoxyphenyl)pyrimidin-2-amine
CID 118709184
5-bromo-4-chloro-6-cyclopentylpyrimidin-2-amine
CID 117260459
5-chloro-6-cyclobutylpyridin-3-amine
CID 105440356

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentylpyrimidine-2,5-diamine?
The IUPAC name of 4-cyclopentylpyrimidine-2,5-diamine (CID 82409896) is 4-cyclopentylpyrimidine-2,5-diamine.
What is the SMILES notation for 4-cyclopentylpyrimidine-2,5-diamine?
The canonical SMILES for 4-cyclopentylpyrimidine-2,5-diamine is Nc1ncc(N)c(C2CCCC2)n1.
What is the InChIKey of 4-cyclopentylpyrimidine-2,5-diamine?
The InChIKey is PKPHTSNSDABBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c10-7-5-12-9(11)13-8(7)6-3-1-2-4-6/h5-6H,1-4,10H2,(H2,11,12,13).
What are the key properties of 4-cyclopentylpyrimidine-2,5-diamine?
4-cyclopentylpyrimidine-2,5-diamine has a molecular weight of 178.24 g/mol, XLogP of 1.30, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentylpyrimidine-2,5-diamine is sourced from PubChem (CID 82409896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).