1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine

C19H36N2 — CID 115306973

IUPAC1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine
SMILESCC(C)(C)C1CCCCC1N1CCC(NCC2CC2)CC1
InChIInChI=1S/C19H36N2/c1-19(2,3)17-6-4-5-7-18(17)21-12-10-16(11-13-21)20-14-15-8-9-15/h15-18,20H,4-14H2,1-3H3
InChIKeyCTOQOBBITNOWDQ-UHFFFAOYSA-N
MW292.51 g/mol
LogP4.06
Rot. Bonds4

About 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine

1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine (PubChem CID 115306973) has the molecular formula C19H36N2 and a molecular weight of 292.51 g/mol. Its IUPAC name is 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine
PubChem CID115306973
Molecular FormulaC19H36N2
Molecular Weight292.51 g/mol
Exact Mass292.29
IUPAC Name1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine
SMILESCC(C)(C)C1CCCCC1N1CCC(NCC2CC2)CC1
InChIInChI=1S/C19H36N2/c1-19(2,3)17-6-4-5-7-18(17)21-12-10-16(11-13-21)20-14-15-8-9-15/h15-18,20H,4-14H2,1-3H3
InChIKeyCTOQOBBITNOWDQ-UHFFFAOYSA-N
XLogP4.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.51
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-cyclohexylethyl)piperidin-4-yl]-N',N'-diethylpropane-1,3-diamine
CID 44389041
N-[1-(cyclohexylmethyl)piperidin-4-yl]-N',N'-diethylpropane-1,3-diamine
CID 44389022
2-(2-Cyclohexyl-2-cyclopropylethyl)piperidine
CID 137638980
3-Azaspiro(5.5)undecane, 9-tert-butyl-3-(3-(dimethylamino)propyl)-, dihydrochloride
CID 56992
4-Tert-butyl-1-[4-[2-(2-cyclopropyl-2-methylpropyl)piperidin-4-yl]-1,1,1-trifluoro-4-methylpentan-2-yl]piperidine
CID 129253189
N-[(1-propylpyrrolidin-3-yl)methyl]-3-azaspiro[5.5]undecan-9-amine
CID 56717118
2-(1-dodecylpiperidin-4-yl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 10970587
2,6,7-trimethyl-N-(3-piperidin-1-ylpropyl)nonan-5-amine
CID 15030012
3-ethyl-7-methyl-N-(3-piperidin-1-ylpropyl)octan-4-amine
CID 15030013
2,2,8,8-tetramethyl-N-(3-piperidin-1-ylpropyl)nonan-5-amine
CID 15030015
2,2,8-trimethyl-N-(3-piperidin-1-ylpropyl)nonan-5-amine
CID 15030017
N-(2-cyclohexylcyclohexyl)-N',N'-dimethylpropane-1,3-diamine
CID 18952677

Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine?
The IUPAC name of 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine (CID 115306973) is 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine.
What is the SMILES notation for 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine?
The canonical SMILES for 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine is CC(C)(C)C1CCCCC1N1CCC(NCC2CC2)CC1.
What is the InChIKey of 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine?
The InChIKey is CTOQOBBITNOWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2/c1-19(2,3)17-6-4-5-7-18(17)21-12-10-16(11-13-21)20-14-15-8-9-15/h15-18,20H,4-14H2,1-3H3.
What are the key properties of 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine?
1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine has a molecular weight of 292.51 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine is sourced from PubChem (CID 115306973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).