4-(cyclopentylmethyl)cyclohexan-1-amine

C12H23N — CID 3523250

IUPAC4-(cyclopentylmethyl)cyclohexan-1-amine
SMILESNC1CCC(CC2CCCC2)CC1
InChIInChI=1S/C12H23N/c13-12-7-5-11(6-8-12)9-10-3-1-2-4-10/h10-12H,1-9,13H2
InChIKeyHJIQQQKDNLJLCB-UHFFFAOYSA-N
MW181.32 g/mol
LogP3.08
Rot. Bonds2

About 4-(cyclopentylmethyl)cyclohexan-1-amine

4-(cyclopentylmethyl)cyclohexan-1-amine (PubChem CID 3523250) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 4-(cyclopentylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(cyclopentylmethyl)cyclohexan-1-amine
PubChem CID3523250
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name4-(cyclopentylmethyl)cyclohexan-1-amine
SMILESNC1CCC(CC2CCCC2)CC1
InChIInChI=1S/C12H23N/c13-12-7-5-11(6-8-12)9-10-3-1-2-4-10/h10-12H,1-9,13H2
InChIKeyHJIQQQKDNLJLCB-UHFFFAOYSA-N
XLogP3.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(cyclopropylmethyl)cyclohexan-1-amine
CID 126845684
4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine;hydrofluoride
CID 70522175
4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine;ethane
CID 159510225
[4-(cyclopentylmethyl)cyclohexyl]methylcycloheptane
CID 140856779
cyclopentadecylmethylcyclopentadecane
CID 91804599
4-[[4-(aminomethyl)cyclohexyl]methyl]cyclohexan-1-amine
CID 54348885
[4-[(4-aminocyclohexyl)methyl]cyclohexyl]azanium
CID 146710523
2-[(2-aminocyclohexyl)methyl]cyclohexan-1-amine;2-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine
CID 118512121
4-[[4-[cyclohexyl(methyl)amino]cyclohexyl]methyl]cyclohexan-1-amine
CID 141217448
4-[(cyclopentylmethylamino)methyl]cyclohexan-1-amine
CID 115213454
carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))
CID 162297269
1-(cyclohexylmethyl)-4-(4-cyclopropylbutyl)cyclohexane
CID 168781110

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-(cyclopentylmethyl)cyclohexan-1-amine (CID 3523250) is 4-(cyclopentylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-(cyclopentylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-(cyclopentylmethyl)cyclohexan-1-amine is NC1CCC(CC2CCCC2)CC1.
What is the InChIKey of 4-(cyclopentylmethyl)cyclohexan-1-amine?
The InChIKey is HJIQQQKDNLJLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c13-12-7-5-11(6-8-12)9-10-3-1-2-4-10/h10-12H,1-9,13H2.
What are the key properties of 4-(cyclopentylmethyl)cyclohexan-1-amine?
4-(cyclopentylmethyl)cyclohexan-1-amine has a molecular weight of 181.32 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 3523250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).