2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine

C13H21N3 — CID 64910084

IUPAC2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine
SMILESCCCNC1CCC(c2cncnc2)C1C
InChIInChI=1S/C13H21N3/c1-3-6-16-13-5-4-12(10(13)2)11-7-14-9-15-8-11/h7-10,12-13,16H,3-6H2,1-2H3
InChIKeyWYANOHSZTUMHOX-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.36
Rot. Bonds4

About 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine

2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine (PubChem CID 64910084) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine.

Molecular Properties

Compound Name2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine
PubChem CID64910084
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine
SMILESCCCNC1CCC(c2cncnc2)C1C
InChIInChI=1S/C13H21N3/c1-3-6-16-13-5-4-12(10(13)2)11-7-14-9-15-8-11/h7-10,12-13,16H,3-6H2,1-2H3
InChIKeyWYANOHSZTUMHOX-UHFFFAOYSA-N
XLogP2.36
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine
CID 64908355
3-(4-fluorophenyl)-2-methyl-N-propylcyclopentan-1-amine
CID 64909010
2,3-dimethyl-N-propyl-1-pyrimidin-5-ylpiperidin-4-amine
CID 107588860
3-(furan-3-yl)-2-methyl-N-propylcyclopentan-1-amine
CID 64909662
3-(3-fluoro-4-pyridinyl)-2-methyl-N-propylcyclopentan-1-amine
CID 104739065
3-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-N-propylcyclopentan-1-amine
CID 107290266
N-ethyl-2-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine
CID 64909644
N-[(2-pyrimidin-5-ylcycloheptyl)methyl]propan-1-amine
CID 81026587
2-methyl-N-propyl-3-quinolin-5-ylcyclopentan-1-amine
CID 81221949
2-methyl-3-phenyl-N-propylcyclobutan-1-amine
CID 81417285
3-cyclopropyl-2-methyl-N-propylcyclopentan-1-amine
CID 64909214
3-(4-chlorophenyl)-N-ethyl-2-methylcyclopentan-1-amine
CID 64908122

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine?
The IUPAC name of 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine (CID 64910084) is 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine.
What is the SMILES notation for 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine?
The canonical SMILES for 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine is CCCNC1CCC(c2cncnc2)C1C.
What is the InChIKey of 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine?
The InChIKey is WYANOHSZTUMHOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-3-6-16-13-5-4-12(10(13)2)11-7-14-9-15-8-11/h7-10,12-13,16H,3-6H2,1-2H3.
What are the key properties of 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine?
2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine is sourced from PubChem (CID 64910084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).