[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine

C17H32N2 — CID 64625427

IUPAC[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCCC1CCCN(C2(CN)CCCC(C3CC3)C2)C1
InChIInChI=1S/C17H32N2/c1-2-14-5-4-10-19(12-14)17(13-18)9-3-6-16(11-17)15-7-8-15/h14-16H,2-13,18H2,1H3
InChIKeyKONRLKIRNYPYMV-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.41
Rot. Bonds4

About [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine

[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine (PubChem CID 64625427) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
PubChem CID64625427
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCCC1CCCN(C2(CN)CCCC(C3CC3)C2)C1
InChIInChI=1S/C17H32N2/c1-2-14-5-4-10-19(12-14)17(13-18)9-3-6-16(11-17)15-7-8-15/h14-16H,2-13,18H2,1H3
InChIKeyKONRLKIRNYPYMV-UHFFFAOYSA-N
XLogP3.41
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
CID 43584374
[1-(3-ethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429133
[3-cyclopropyl-1-(3,4-dimethylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 79188405
[3-cyclopropyl-1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)cyclohexyl]methanamine
CID 79166206
[4-tert-butyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 43584372
[1-(3-ethylpyrrolidin-1-yl)-3-methoxycyclohexyl]methanamine
CID 106872732
[1-(8-azaspiro[4.5]decan-8-yl)-3-cyclopropylcyclohexyl]methanamine
CID 64625031
[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
CID 43809104
[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
CID 66392860
[3-cyclopropyl-1-(2-ethyl-5-methylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 83227967
1-[1-(aminomethyl)-4-ethylcycloheptyl]-N,N-dimethylpyrrolidin-3-amine
CID 65088382
[1-(3-ethylpiperidin-1-yl)-2,4,4-trimethylcyclohexyl]methanamine
CID 81320901

Frequently Asked Questions

What is the IUPAC name of [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine (CID 64625427) is [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine is CCC1CCCN(C2(CN)CCCC(C3CC3)C2)C1.
What is the InChIKey of [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine?
The InChIKey is KONRLKIRNYPYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-2-14-5-4-10-19(12-14)17(13-18)9-3-6-16(11-17)15-7-8-15/h14-16H,2-13,18H2,1H3.
What are the key properties of [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine?
[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine has a molecular weight of 264.46 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 64625427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).