3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine

C15H22ClN — CID 64908355

IUPAC3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine
SMILESCCCNC1CCC(c2ccc(Cl)cc2)C1C
InChIInChI=1S/C15H22ClN/c1-3-10-17-15-9-8-14(11(15)2)12-4-6-13(16)7-5-12/h4-7,11,14-15,17H,3,8-10H2,1-2H3
InChIKeyRWCKQSNPUJLJGT-UHFFFAOYSA-N
MW251.80 g/mol
LogP4.22
Rot. Bonds4

About 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine

3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine (PubChem CID 64908355) has the molecular formula C15H22ClN and a molecular weight of 251.80 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine
PubChem CID64908355
Molecular FormulaC15H22ClN
Molecular Weight251.80 g/mol
Exact Mass251.14
IUPAC Name3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine
SMILESCCCNC1CCC(c2ccc(Cl)cc2)C1C
InChIInChI=1S/C15H22ClN/c1-3-10-17-15-9-8-14(11(15)2)12-4-6-13(16)7-5-12/h4-7,11,14-15,17H,3,8-10H2,1-2H3
InChIKeyRWCKQSNPUJLJGT-UHFFFAOYSA-N
XLogP4.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.80
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-chlorophenyl)-N-ethyl-2-methylcyclopentan-1-amine
CID 64908122
3-(4-fluorophenyl)-2-methyl-N-propylcyclopentan-1-amine
CID 64909010
3-(furan-3-yl)-2-methyl-N-propylcyclopentan-1-amine
CID 64909662
3-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-N-propylcyclopentan-1-amine
CID 107290266
2-methyl-N-propyl-3-pyrimidin-5-ylcyclopentan-1-amine
CID 64910084
2-methyl-3-phenyl-N-propylcyclobutan-1-amine
CID 81417285
3-(3-fluoro-4-pyridinyl)-2-methyl-N-propylcyclopentan-1-amine
CID 104739065
3-(2,5-dichlorophenyl)-2-methyl-N-propylcyclobutan-1-amine
CID 81417802
1-(2,4-dichlorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397728
1-(5-chloro-2-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79396532
N-[[2-(4-chlorophenyl)cyclohexyl]methyl]propan-1-amine
CID 81027108
3-(3-chloro-4-fluorophenyl)sulfinyl-2-methyl-N-propylcyclopentan-1-amine
CID 115477312

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine?
The IUPAC name of 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine (CID 64908355) is 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine.
What is the SMILES notation for 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine?
The canonical SMILES for 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine is CCCNC1CCC(c2ccc(Cl)cc2)C1C.
What is the InChIKey of 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine?
The InChIKey is RWCKQSNPUJLJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN/c1-3-10-17-15-9-8-14(11(15)2)12-4-6-13(16)7-5-12/h4-7,11,14-15,17H,3,8-10H2,1-2H3.
What are the key properties of 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine?
3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine has a molecular weight of 251.80 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-2-methyl-N-propylcyclopentan-1-amine is sourced from PubChem (CID 64908355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).