N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine

C15H22ClNO — CID 65124397

IUPACN-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine
SMILESCCNCC1(OCc2cccc(Cl)c2)CCCC1
InChIInChI=1S/C15H22ClNO/c1-2-17-12-15(8-3-4-9-15)18-11-13-6-5-7-14(16)10-13/h5-7,10,17H,2-4,8-9,11-12H2,1H3
InChIKeyYFTIARAMXZEKFQ-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.78
Rot. Bonds6

About N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine

N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine (PubChem CID 65124397) has the molecular formula C15H22ClNO and a molecular weight of 267.80 g/mol. Its IUPAC name is N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine
PubChem CID65124397
Molecular FormulaC15H22ClNO
Molecular Weight267.80 g/mol
Exact Mass267.14
IUPAC NameN-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine
SMILESCCNCC1(OCc2cccc(Cl)c2)CCCC1
InChIInChI=1S/C15H22ClNO/c1-2-17-12-15(8-3-4-9-15)18-11-13-6-5-7-14(16)10-13/h5-7,10,17H,2-4,8-9,11-12H2,1H3
InChIKeyYFTIARAMXZEKFQ-UHFFFAOYSA-N
XLogP3.78
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-[(3-chlorophenyl)methoxy]cyclohexyl]methyl]cyclopropanamine
CID 65124979
N-[[1-[(3-chlorophenyl)methoxy]-3-methylcyclohexyl]methyl]propan-1-amine
CID 65124692
N-[[1-[(3-chlorophenyl)methoxy]-4-methylcyclohexyl]methyl]cyclopropanamine
CID 65124443
N-[[1-[(4-bromophenyl)methoxy]cyclopentyl]methyl]ethanamine
CID 82831812
N-[[1-[(3-bromophenyl)methoxy]cyclopentyl]methyl]propan-1-amine
CID 82831973
1-[1-[(3-chlorophenyl)methyl]cyclopentyl]-N-methylmethanamine
CID 62726411
N-[[1-[(2-fluorophenyl)methoxy]cycloheptyl]methyl]ethanamine
CID 63932831
1-[[(3-chlorophenyl)methylamino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 28530508
3-[(3-chlorophenyl)methoxy]-N-methylspiro[3.5]nonan-1-amine
CID 66349861
2-(3-chlorophenyl)-1-(1-ethoxycyclohexyl)-N-ethylethanamine
CID 116764102
2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine
CID 116714621
1-[1-[(3-chlorophenyl)methyl]cyclopropyl]-N-methylmethanamine
CID 66024867

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine?
The IUPAC name of N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine (CID 65124397) is N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine?
The canonical SMILES for N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine is CCNCC1(OCc2cccc(Cl)c2)CCCC1.
What is the InChIKey of N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine?
The InChIKey is YFTIARAMXZEKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO/c1-2-17-12-15(8-3-4-9-15)18-11-13-6-5-7-14(16)10-13/h5-7,10,17H,2-4,8-9,11-12H2,1H3.
What are the key properties of N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine?
N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine has a molecular weight of 267.80 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(3-chlorophenyl)methoxy]cyclopentyl]methyl]ethanamine is sourced from PubChem (CID 65124397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).