[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine

C17H34N2 — CID 63470394

IUPAC[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine
SMILESCCC1CCCCN1C1(CN)CCC(C(C)C)CC1
InChIInChI=1S/C17H34N2/c1-4-16-7-5-6-12-19(16)17(13-18)10-8-15(9-11-17)14(2)3/h14-16H,4-13,18H2,1-3H3
InChIKeySQIJOWLNJXPFBO-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.79
Rot. Bonds4

About [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine

[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine (PubChem CID 63470394) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine
PubChem CID63470394
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine
SMILESCCC1CCCCN1C1(CN)CCC(C(C)C)CC1
InChIInChI=1S/C17H34N2/c1-4-16-7-5-6-12-19(16)17(13-18)10-8-15(9-11-17)14(2)3/h14-16H,4-13,18H2,1-3H3
InChIKeySQIJOWLNJXPFBO-UHFFFAOYSA-N
XLogP3.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2-ethylpyrrolidin-1-yl)-3-propan-2-ylcyclobutyl]methanamine
CID 103562653
[4-(2-ethylpiperidin-1-yl)-1-methylpiperidin-4-yl]methanamine
CID 43266395
[4-ethyl-1-(2-ethylpiperidin-1-yl)cycloheptyl]methanamine
CID 65088511
1-[1-[1-(aminomethyl)-4-propan-2-ylcyclohexyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 62884867
[4-(2-ethylazepan-1-yl)thian-4-yl]methanamine
CID 104689235
[1-(2-methylazepan-1-yl)-4-propan-2-ylcycloheptyl]methanamine
CID 65089102
[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107428917
[8-(2-ethylpyrrolidin-1-yl)spiro[4.5]decan-8-yl]methanamine
CID 114818062
[3-(2-ethylazepan-1-yl)oxolan-3-yl]methanamine
CID 104689369
[1-(2-ethylpiperidin-1-yl)-3-methoxycyclobutyl]methanamine
CID 106821751
[3-(2-ethylpiperidin-1-yl)-1,1-dioxothian-3-yl]methanamine
CID 63921849
[1-(2-ethylpiperidin-1-yl)-3-(trifluoromethyl)cyclohexyl]methanamine
CID 64758210

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine?
The IUPAC name of [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine (CID 63470394) is [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine.
What is the SMILES notation for [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine?
The canonical SMILES for [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine is CCC1CCCCN1C1(CN)CCC(C(C)C)CC1.
What is the InChIKey of [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine?
The InChIKey is SQIJOWLNJXPFBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-16-7-5-6-12-19(16)17(13-18)10-8-15(9-11-17)14(2)3/h14-16H,4-13,18H2,1-3H3.
What are the key properties of [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine?
[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine has a molecular weight of 266.47 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine is sourced from PubChem (CID 63470394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).