4-(azepan-1-yl)cyclohexan-1-amine

C12H24N2 — CID 62807611

IUPAC4-(azepan-1-yl)cyclohexan-1-amine
SMILESNC1CCC(N2CCCCCC2)CC1
InChIInChI=1S/C12H24N2/c13-11-5-7-12(8-6-11)14-9-3-1-2-4-10-14/h11-12H,1-10,13H2
InChIKeyDFNBBVSDYNTQTB-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.13
Rot. Bonds1

About 4-(azepan-1-yl)cyclohexan-1-amine

4-(azepan-1-yl)cyclohexan-1-amine (PubChem CID 62807611) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-(azepan-1-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(azepan-1-yl)cyclohexan-1-amine
PubChem CID62807611
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-(azepan-1-yl)cyclohexan-1-amine
SMILESNC1CCC(N2CCCCCC2)CC1
InChIInChI=1S/C12H24N2/c13-11-5-7-12(8-6-11)14-9-3-1-2-4-10-14/h11-12H,1-10,13H2
InChIKeyDFNBBVSDYNTQTB-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-piperidin-1-ylpiperidin-1-yl)cyclohexan-1-amine
CID 62806389
4-pyrrolidin-1-ylcyclohexan-1-amine;dihydrochloride
CID 119057158
1-cyclopropylpiperidine
CID 10909573
1-cyclohexylazocane
CID 23151203
1-cyclooctylpyrrolidine
CID 23277874
1-cyclooctylpiperidine
CID 89210756
(4-aminocyclohexyl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 60953970
3-(azocan-1-yl)cyclobutan-1-amine
CID 80561417
3-(azonan-1-yl)cyclobutan-1-amine
CID 130631518
1-cyclohexylpiperidine;methane
CID 143122486
4-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]cyclohexan-1-amine
CID 58153963
4-piperidin-1-yl-1-sulfanylpiperidine
CID 90720397

Frequently Asked Questions

What is the IUPAC name of 4-(azepan-1-yl)cyclohexan-1-amine?
The IUPAC name of 4-(azepan-1-yl)cyclohexan-1-amine (CID 62807611) is 4-(azepan-1-yl)cyclohexan-1-amine.
What is the SMILES notation for 4-(azepan-1-yl)cyclohexan-1-amine?
The canonical SMILES for 4-(azepan-1-yl)cyclohexan-1-amine is NC1CCC(N2CCCCCC2)CC1.
What is the InChIKey of 4-(azepan-1-yl)cyclohexan-1-amine?
The InChIKey is DFNBBVSDYNTQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c13-11-5-7-12(8-6-11)14-9-3-1-2-4-10-14/h11-12H,1-10,13H2.
What are the key properties of 4-(azepan-1-yl)cyclohexan-1-amine?
4-(azepan-1-yl)cyclohexan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azepan-1-yl)cyclohexan-1-amine is sourced from PubChem (CID 62807611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).