N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine

C15H29NO — CID 65046770

IUPACN-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine
SMILESCC1CCCC1NCCCOC1CCCCC1
InChIInChI=1S/C15H29NO/c1-13-7-5-10-15(13)16-11-6-12-17-14-8-3-2-4-9-14/h13-16H,2-12H2,1H3
InChIKeyYCOSGDISLQODLY-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.50
Rot. Bonds6

About N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine

N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine (PubChem CID 65046770) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine
PubChem CID65046770
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine
SMILESCC1CCCC1NCCCOC1CCCCC1
InChIInChI=1S/C15H29NO/c1-13-7-5-10-15(13)16-11-6-12-17-14-8-3-2-4-9-14/h13-16H,2-12H2,1H3
InChIKeyYCOSGDISLQODLY-UHFFFAOYSA-N
XLogP3.50
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyclohexyloxypropyl)-2,4-dimethylcyclohexan-1-amine
CID 64776416
trans-(1R,2R)-N-(3-methoxypropyl)-2-methylcyclopentan-1-amine
CID 95377511
N-(3-cyclohexyloxypropyl)-2-methoxycyclohexan-1-amine
CID 43770852
N-(3-cyclohexyloxypropyl)-2-methyloxolan-3-amine
CID 113289548
(2R,3R)-N-(3-cyclohexyloxypropyl)-2-methyloxolan-3-amine
CID 124568299
N-(3-cycloheptyloxypropyl)cyclohexanamine
CID 62583654
N-(3-cyclohexyloxypropyl)cyclopentanamine
CID 28720049
2-methyl-N-(3-propan-2-yloxypropyl)cyclohexan-1-amine
CID 43183143
cis-(1R,2S)-N-(4-methoxybutyl)-2-methylcyclopentan-1-amine
CID 96923239
trans-(1R,2R)-N-(4-methoxybutyl)-2-methylcyclopentan-1-amine
CID 96923238
N-(3-cyclohexyloxypropyl)-3-methylcyclopentan-1-amine
CID 64501250
6-[(2-methylcyclopentyl)amino]hexan-1-ol
CID 115906759

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine?
The IUPAC name of N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine (CID 65046770) is N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine.
What is the SMILES notation for N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine?
The canonical SMILES for N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine is CC1CCCC1NCCCOC1CCCCC1.
What is the InChIKey of N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine?
The InChIKey is YCOSGDISLQODLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-13-7-5-10-15(13)16-11-6-12-17-14-8-3-2-4-9-14/h13-16H,2-12H2,1H3.
What are the key properties of N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine?
N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine has a molecular weight of 239.40 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyloxypropyl)-2-methylcyclopentan-1-amine is sourced from PubChem (CID 65046770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).