4-cyclopentyl-4-methoxycyclohexan-1-amine

C12H23NO — CID 142274260

IUPAC4-cyclopentyl-4-methoxycyclohexan-1-amine
SMILESCOC1(C2CCCC2)CCC(N)CC1
InChIInChI=1S/C12H23NO/c1-14-12(10-4-2-3-5-10)8-6-11(13)7-9-12/h10-11H,2-9,13H2,1H3
InChIKeyLZKYGERVTQIKGG-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.46
Rot. Bonds2

About 4-cyclopentyl-4-methoxycyclohexan-1-amine

4-cyclopentyl-4-methoxycyclohexan-1-amine (PubChem CID 142274260) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 4-cyclopentyl-4-methoxycyclohexan-1-amine.

Molecular Properties

Compound Name4-cyclopentyl-4-methoxycyclohexan-1-amine
PubChem CID142274260
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name4-cyclopentyl-4-methoxycyclohexan-1-amine
SMILESCOC1(C2CCCC2)CCC(N)CC1
InChIInChI=1S/C12H23NO/c1-14-12(10-4-2-3-5-10)8-6-11(13)7-9-12/h10-11H,2-9,13H2,1H3
InChIKeyLZKYGERVTQIKGG-UHFFFAOYSA-N
XLogP2.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Amino-1-(propan-2-yl)cyclohexan-1-ol hydrochloride
CID 66642763
4-Methoxy-4-methylcyclohexan-1-amine
CID 112707206
4-Amino-1-(propan-2-yl)cyclohexan-1-ol
CID 65917740
trans-4-(2-Methoxypropan-2-yl)cyclohexan-1-amine
CID 89166588
4-ethoxy-4-methylCyclohexanamine
CID 112707210
trans-(1R,3R)-3-(2-methoxypropan-2-yl)cyclohexan-1-amine
CID 142750709
Ethane;1-oxaspiro[4.5]decan-8-amine
CID 143817931
4-(2-Methoxy-2-methylpropyl)cyclohexan-1-amine
CID 168960491
4-Amino-1-(cyclopentylmethyl)cyclohexan-1-ol
CID 65915543
4-Amino-1-(2-methylpentyl)cyclohexan-1-ol
CID 65916545
4-Amino-1-(2-methylbutyl)cyclohexan-1-ol
CID 65916737
4-Amino-1-cyclopentylcyclohexan-1-ol
CID 65916935

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-4-methoxycyclohexan-1-amine?
The IUPAC name of 4-cyclopentyl-4-methoxycyclohexan-1-amine (CID 142274260) is 4-cyclopentyl-4-methoxycyclohexan-1-amine.
What is the SMILES notation for 4-cyclopentyl-4-methoxycyclohexan-1-amine?
The canonical SMILES for 4-cyclopentyl-4-methoxycyclohexan-1-amine is COC1(C2CCCC2)CCC(N)CC1.
What is the InChIKey of 4-cyclopentyl-4-methoxycyclohexan-1-amine?
The InChIKey is LZKYGERVTQIKGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-14-12(10-4-2-3-5-10)8-6-11(13)7-9-12/h10-11H,2-9,13H2,1H3.
What are the key properties of 4-cyclopentyl-4-methoxycyclohexan-1-amine?
4-cyclopentyl-4-methoxycyclohexan-1-amine has a molecular weight of 197.32 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-4-methoxycyclohexan-1-amine is sourced from PubChem (CID 142274260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).