2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine

C18H23N3 — CID 63485261

IUPAC2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ccnc(C2(c3ccccc3)CCCC2)n1
InChIInChI=1S/C18H23N3/c1-2-13-19-16-10-14-20-17(21-16)18(11-6-7-12-18)15-8-4-3-5-9-15/h3-5,8-10,14H,2,6-7,11-13H2,1H3,(H,19,20,21)
InChIKeyOBCDZOUMEFAHOF-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.16
Rot. Bonds5

About 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine

2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine (PubChem CID 63485261) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine
PubChem CID63485261
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ccnc(C2(c3ccccc3)CCCC2)n1
InChIInChI=1S/C18H23N3/c1-2-13-19-16-10-14-20-17(21-16)18(11-6-7-12-18)15-8-4-3-5-9-15/h3-5,8-10,14H,2,6-7,11-13H2,1H3,(H,19,20,21)
InChIKeyOBCDZOUMEFAHOF-UHFFFAOYSA-N
XLogP4.16
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-phenylcyclobutyl)-N-propylpyrimidin-4-amine
CID 63078296
N-ethyl-2-(1-phenylcyclobutyl)pyrimidin-4-amine
CID 63081004
2-(1-ethoxycyclohexyl)-N-propylpyrimidin-4-amine
CID 116776076
(1S)-1-[3-(1-phenylcyclopentyl)-1,2,4-oxadiazol-5-yl]butan-1-amine
CID 107565318
2-(1-ethoxy-4-methylcyclohexyl)-N-propylpyrimidin-4-amine
CID 116776078
N,6-diethyl-2-(1-phenylcyclobutyl)pyrimidin-4-amine
CID 63486293
1-[3-(1-phenylcyclopentyl)-1,2,4-oxadiazol-5-yl]ethanol
CID 63349809
5-iodo-6-methyl-2-(1-phenylcyclopropyl)-N-propylpyrimidin-4-amine
CID 66306724
(1R)-1-[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 104915277
(1S)-1-[3-(1-phenylcyclopentyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 95010794
4-ethyl-2-(1-phenylcyclobutyl)pyrimidine-5-carboxylic acid
CID 63080630
N-[[2-(1-phenylcyclopentyl)-1H-imidazol-5-yl]methyl]propan-1-amine
CID 63109245

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine (CID 63485261) is 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine is CCCNc1ccnc(C2(c3ccccc3)CCCC2)n1.
What is the InChIKey of 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine?
The InChIKey is OBCDZOUMEFAHOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-2-13-19-16-10-14-20-17(21-16)18(11-6-7-12-18)15-8-4-3-5-9-15/h3-5,8-10,14H,2,6-7,11-13H2,1H3,(H,19,20,21).
What are the key properties of 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine?
2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenylcyclopentyl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 63485261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).