1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine

C18H36N2 — CID 63452666

IUPAC1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine
SMILESCCN1CCCC(NC2CCC(C(C)(C)CC)CC2)C1
InChIInChI=1S/C18H36N2/c1-5-18(3,4)15-9-11-16(12-10-15)19-17-8-7-13-20(6-2)14-17/h15-17,19H,5-14H2,1-4H3
InChIKeyNGBYAKSAICOQDB-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.06
Rot. Bonds5

About 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine

1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine (PubChem CID 63452666) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine.

Molecular Properties

Compound Name1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine
PubChem CID63452666
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine
SMILESCCN1CCCC(NC2CCC(C(C)(C)CC)CC2)C1
InChIInChI=1S/C18H36N2/c1-5-18(3,4)15-9-11-16(12-10-15)19-17-8-7-13-20(6-2)14-17/h15-17,19H,5-14H2,1-4H3
InChIKeyNGBYAKSAICOQDB-UHFFFAOYSA-N
XLogP4.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine
CID 65070247
N-(1-cyclopropylpyrrolidin-3-yl)-1-ethylpiperidin-3-amine
CID 62982857
N-cyclopropyl-1-(2,3,3-trimethylbutyl)piperidin-3-amine
CID 83147276
N-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-3-amine
CID 114401290
N-cyclopropyl-1-(2-methoxy-2-methylpropyl)piperidin-3-amine
CID 104766166
1-ethyl-N-(5-methylthiolan-3-yl)piperidin-3-amine
CID 79950427
N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine
CID 103465025
N-cyclopropyl-1-[2-(1-methylpiperidin-4-yl)ethyl]piperidin-3-amine
CID 114516764
4-(2-methylbutan-2-yl)-N-(2-methylcyclopentyl)cyclohexan-1-amine
CID 63463108
2,2-dimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-1,3-dioxan-5-amine
CID 106658207
1-cyclopropyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589816
3-tert-butyl-1-ethylpiperidine;ethane
CID 155704046

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine?
The IUPAC name of 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine (CID 63452666) is 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine.
What is the SMILES notation for 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine?
The canonical SMILES for 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine is CCN1CCCC(NC2CCC(C(C)(C)CC)CC2)C1.
What is the InChIKey of 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine?
The InChIKey is NGBYAKSAICOQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-5-18(3,4)15-9-11-16(12-10-15)19-17-8-7-13-20(6-2)14-17/h15-17,19H,5-14H2,1-4H3.
What are the key properties of 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine?
1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine has a molecular weight of 280.50 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine is sourced from PubChem (CID 63452666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).