1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine

C16H32N2 — CID 113282880

IUPAC1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(C2CCCC(C)(C)CC2)CC1
InChIInChI=1S/C16H32N2/c1-15(2)8-5-6-14(7-9-15)18-12-10-16(3,17-4)11-13-18/h14,17H,5-13H2,1-4H3
InChIKeyPTECOYBJNPFGSE-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds2

About 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine

1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine (PubChem CID 113282880) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine
PubChem CID113282880
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(C2CCCC(C)(C)CC2)CC1
InChIInChI=1S/C16H32N2/c1-15(2)8-5-6-14(7-9-15)18-12-10-16(3,17-4)11-13-18/h14,17H,5-13H2,1-4H3
InChIKeyPTECOYBJNPFGSE-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclobutyl-N,4-dimethylpiperidin-4-amine
CID 115304164
1-(3,3-dimethylcyclopentyl)-N,4-dimethylpiperidin-4-amine
CID 115304134
1-cyclobutyl-4,4-dimethylpiperidine
CID 70344031
1-(4,4-dimethylcycloheptyl)-N-methylpyrrolidin-3-amine
CID 115300022
N,4-dimethyl-1-(3-methylsulfonylcyclohexyl)piperidin-4-amine
CID 115305383
N,4-dimethyl-1-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-4-amine
CID 115304011
1-[1-(4,4-dimethylcycloheptyl)piperidin-4-yl]ethanamine
CID 65085464
N,N-dimethyl-4-[4-methyl-4-(methylamino)piperidin-1-yl]piperidine-1-carboxamide
CID 83261821
1-[(1S)-3,3-dimethylcyclohexyl]-4-methylpiperidine
CID 70971560
2-[1-(4,4-dimethylcycloheptyl)piperidin-4-yl]acetic acid
CID 79605937
1-(2-ethyl-2-methyloxan-4-yl)-N,4-dimethylpiperidin-4-amine
CID 113282868
1-(4-tert-butylcyclohexyl)-4-(3,3-dimethylcyclohexyl)piperazine
CID 14553998

Frequently Asked Questions

What is the IUPAC name of 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine?
The IUPAC name of 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine (CID 113282880) is 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine is CNC1(C)CCN(C2CCCC(C)(C)CC2)CC1.
What is the InChIKey of 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine?
The InChIKey is PTECOYBJNPFGSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-15(2)8-5-6-14(7-9-15)18-12-10-16(3,17-4)11-13-18/h14,17H,5-13H2,1-4H3.
What are the key properties of 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine?
1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-dimethylcycloheptyl)-N,4-dimethylpiperidin-4-amine is sourced from PubChem (CID 113282880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).