2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine

C10H20ClNO — CID 106364907

IUPAC2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine
SMILESCOCCCNC1CCCC1CCl
InChIInChI=1S/C10H20ClNO/c1-13-7-3-6-12-10-5-2-4-9(10)8-11/h9-10,12H,2-8H2,1H3
InChIKeySZXXGFKXIFPQJY-UHFFFAOYSA-N
MW205.73 g/mol
LogP2.02
Rot. Bonds6

About 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine

2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine (PubChem CID 106364907) has the molecular formula C10H20ClNO and a molecular weight of 205.73 g/mol. Its IUPAC name is 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine
PubChem CID106364907
Molecular FormulaC10H20ClNO
Molecular Weight205.73 g/mol
Exact Mass205.12
IUPAC Name2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine
SMILESCOCCCNC1CCCC1CCl
InChIInChI=1S/C10H20ClNO/c1-13-7-3-6-12-10-5-2-4-9(10)8-11/h9-10,12H,2-8H2,1H3
InChIKeySZXXGFKXIFPQJY-UHFFFAOYSA-N
XLogP2.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.73
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-(chloromethyl)-N-(3-ethoxypropyl)cyclopentan-1-amine
CID 106365073
2-(chloromethyl)-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-amine
CID 106365344
trans-(1R,2R)-N-(3-methoxypropyl)-2-methylcyclopentan-1-amine
CID 95377511
cis-(1R,2S)-N-(4-methoxybutyl)-2-methylcyclopentan-1-amine
CID 96923239
trans-(1R,2R)-N-(4-methoxybutyl)-2-methylcyclopentan-1-amine
CID 96923238
cis-(1R,2R)-2-tert-butyl-N-(3-methoxypropyl)cyclohexan-1-amine
CID 28673271
2-(chloromethyl)-N-(2-ethylsulfanylethyl)cyclopentan-1-amine
CID 106365119
2-(chloromethyl)-N-(2-fluoroethyl)cyclohexan-1-amine
CID 106365146
2-(chloromethyl)-N-[2-(3-methylbutoxy)ethyl]cyclohexan-1-amine
CID 106365230
(1R,2S,6S,7S,8R)-N-(3-methoxypropyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 124708804
trans-(1R,2R)-2-(3-methoxypropylamino)cyclobutan-1-ol
CID 131701462
2-[[3-methoxypropyl(methyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63009366

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine?
The IUPAC name of 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine (CID 106364907) is 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine.
What is the SMILES notation for 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine?
The canonical SMILES for 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine is COCCCNC1CCCC1CCl.
What is the InChIKey of 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine?
The InChIKey is SZXXGFKXIFPQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20ClNO/c1-13-7-3-6-12-10-5-2-4-9(10)8-11/h9-10,12H,2-8H2,1H3.
What are the key properties of 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine?
2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine has a molecular weight of 205.73 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-N-(3-methoxypropyl)cyclopentan-1-amine is sourced from PubChem (CID 106364907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).