(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine

C16H31N — CID 65411202

IUPAC(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine
SMILESCCC1CCC(C(N)C2CC(C)CC(C)C2)C1
InChIInChI=1S/C16H31N/c1-4-13-5-6-14(10-13)16(17)15-8-11(2)7-12(3)9-15/h11-16H,4-10,17H2,1-3H3
InChIKeyKYLMBFMIFXUJQD-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.21
Rot. Bonds3

About (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine

(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine (PubChem CID 65411202) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine.

Molecular Properties

Compound Name(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine
PubChem CID65411202
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine
SMILESCCC1CCC(C(N)C2CC(C)CC(C)C2)C1
InChIInChI=1S/C16H31N/c1-4-13-5-6-14(10-13)16(17)15-8-11(2)7-12(3)9-15/h11-16H,4-10,17H2,1-3H3
InChIKeyKYLMBFMIFXUJQD-UHFFFAOYSA-N
XLogP4.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,5-dimethylcyclohexyl)-(4-propylcyclohexyl)methanamine
CID 65424912
1-(3-ethylcyclopentyl)ethanamine
CID 65411210
1-(3-ethylcyclopentyl)propan-1-amine
CID 65410017
(4-tert-butylcyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
CID 65402362
1-(3-ethylcyclopentyl)-2,2-dimethylpropan-1-amine
CID 65411012
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(3-ethylcyclohexyl)methanamine
CID 104992511
[(3-ethylcyclopentyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105233577
1-(3,5-dimethylcycloheptyl)propan-1-amine
CID 145017744
cyclopropyl-(3-ethylcyclopentyl)methanol
CID 65411720
1-(1-bromoethyl)-3-ethylcyclopentane
CID 66470468
trans-(1R,3R)-1-ethyl-3-methylcyclopentane
CID 6432281
(3-ethylcyclohexyl)-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 105156191

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine?
The IUPAC name of (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine (CID 65411202) is (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine.
What is the SMILES notation for (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine?
The canonical SMILES for (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine is CCC1CCC(C(N)C2CC(C)CC(C)C2)C1.
What is the InChIKey of (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine?
The InChIKey is KYLMBFMIFXUJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-4-13-5-6-14(10-13)16(17)15-8-11(2)7-12(3)9-15/h11-16H,4-10,17H2,1-3H3.
What are the key properties of (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine?
(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine has a molecular weight of 237.43 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine is sourced from PubChem (CID 65411202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).