1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine

C14H20ClNO — CID 55022905

IUPAC1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine
SMILESCC(N)C(OC1CCCC1)c1ccccc1Cl
InChIInChI=1S/C14H20ClNO/c1-10(16)14(17-11-6-2-3-7-11)12-8-4-5-9-13(12)15/h4-5,8-11,14H,2-3,6-7,16H2,1H3
InChIKeyNCKVEQUWSDCABP-UHFFFAOYSA-N
MW253.77 g/mol
LogP3.69
Rot. Bonds4

About 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine

1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine (PubChem CID 55022905) has the molecular formula C14H20ClNO and a molecular weight of 253.77 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine
PubChem CID55022905
Molecular FormulaC14H20ClNO
Molecular Weight253.77 g/mol
Exact Mass253.12
IUPAC Name1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine
SMILESCC(N)C(OC1CCCC1)c1ccccc1Cl
InChIInChI=1S/C14H20ClNO/c1-10(16)14(17-11-6-2-3-7-11)12-8-4-5-9-13(12)15/h4-5,8-11,14H,2-3,6-7,16H2,1H3
InChIKeyNCKVEQUWSDCABP-UHFFFAOYSA-N
XLogP3.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.77
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-1-(2-ethylcyclohexyl)oxypropan-2-amine
CID 63457119
1-(2-chlorophenyl)-1-(cyclohexylmethoxy)propan-2-amine
CID 55066579
1-cyclohexyloxy-1-phenylpropan-2-amine
CID 55017556
1-(4-chlorophenyl)-1-cyclohexyloxypropan-2-amine
CID 55015439
1-chloro-2-(1-cyclopentyloxy-2-iodoethyl)benzene
CID 114772493
1-cyclopentyloxy-1-(3-methylphenyl)propan-2-amine
CID 55020466
1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine
CID 55022474
1-(2-chlorophenyl)-N-cyclopentyloxyethanamine
CID 83228544
1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine
CID 55018597
1-(2-bromo-1-cyclohexyloxyethyl)-2-chlorobenzene
CID 63468804
1-(2-methylphenyl)-1-(oxolan-3-yloxy)propan-2-amine
CID 63559231
(R)-(2-chlorophenyl)-cyclopentylmethanamine
CID 91256846

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine?
The IUPAC name of 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine (CID 55022905) is 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine.
What is the SMILES notation for 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine?
The canonical SMILES for 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine is CC(N)C(OC1CCCC1)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine?
The InChIKey is NCKVEQUWSDCABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO/c1-10(16)14(17-11-6-2-3-7-11)12-8-4-5-9-13(12)15/h4-5,8-11,14H,2-3,6-7,16H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine?
1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine has a molecular weight of 253.77 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine is sourced from PubChem (CID 55022905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).