(4-butylcyclohexyl)-cyclopropylmethanamine

C14H27N — CID 104994185

IUPAC(4-butylcyclohexyl)-cyclopropylmethanamine
SMILESCCCCC1CCC(C(N)C2CC2)CC1
InChIInChI=1S/C14H27N/c1-2-3-4-11-5-7-12(8-6-11)14(15)13-9-10-13/h11-14H,2-10,15H2,1H3
InChIKeyXOBCRQQJCVTYCJ-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.72
Rot. Bonds5

About (4-butylcyclohexyl)-cyclopropylmethanamine

(4-butylcyclohexyl)-cyclopropylmethanamine (PubChem CID 104994185) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is (4-butylcyclohexyl)-cyclopropylmethanamine.

Molecular Properties

Compound Name(4-butylcyclohexyl)-cyclopropylmethanamine
PubChem CID104994185
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name(4-butylcyclohexyl)-cyclopropylmethanamine
SMILESCCCCC1CCC(C(N)C2CC2)CC1
InChIInChI=1S/C14H27N/c1-2-3-4-11-5-7-12(8-6-11)14(15)13-9-10-13/h11-14H,2-10,15H2,1H3
InChIKeyXOBCRQQJCVTYCJ-UHFFFAOYSA-N
XLogP3.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclopropyl-(4-propylcyclohexyl)methanamine
CID 65424533
hexane;pentylcyclopropane
CID 159592467
1-butyl-4-(2-cyclopentylethyl)cyclohexane
CID 157379859
1,4-dihexylcyclohexane
CID 22947938
octadecane;pentadecylcyclopropane
CID 173301851
tetradecane;undecylcyclopropane
CID 173215670
1-dodecyl-4-pentadecylcyclohexane
CID 123560684
1-(4-butylcyclohexyl)-2-(oxan-4-yl)ethanamine
CID 115846799
1-(4-butylcyclohexyl)pent-4-yn-1-amine
CID 115859309
(3,5-dimethylcyclohexyl)-(4-propylcyclohexyl)methanamine
CID 65424912
1-chloropentane;dicyclopropylmethanamine
CID 174752462
azane;hexylcyclopropane
CID 135322230

Frequently Asked Questions

What is the IUPAC name of (4-butylcyclohexyl)-cyclopropylmethanamine?
The IUPAC name of (4-butylcyclohexyl)-cyclopropylmethanamine (CID 104994185) is (4-butylcyclohexyl)-cyclopropylmethanamine.
What is the SMILES notation for (4-butylcyclohexyl)-cyclopropylmethanamine?
The canonical SMILES for (4-butylcyclohexyl)-cyclopropylmethanamine is CCCCC1CCC(C(N)C2CC2)CC1.
What is the InChIKey of (4-butylcyclohexyl)-cyclopropylmethanamine?
The InChIKey is XOBCRQQJCVTYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-2-3-4-11-5-7-12(8-6-11)14(15)13-9-10-13/h11-14H,2-10,15H2,1H3.
What are the key properties of (4-butylcyclohexyl)-cyclopropylmethanamine?
(4-butylcyclohexyl)-cyclopropylmethanamine has a molecular weight of 209.38 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-butylcyclohexyl)-cyclopropylmethanamine is sourced from PubChem (CID 104994185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).