N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine

C16H32N2 — CID 65045533

IUPACN,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine
SMILESCC1CCCC(CNC2CCCC2C)(N(C)C)C1
InChIInChI=1S/C16H32N2/c1-13-7-6-10-16(11-13,18(3)4)12-17-15-9-5-8-14(15)2/h13-15,17H,5-12H2,1-4H3
InChIKeyWLICQFNSDLNTEQ-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds4

About N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine

N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine (PubChem CID 65045533) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine
PubChem CID65045533
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine
SMILESCC1CCCC(CNC2CCCC2C)(N(C)C)C1
InChIInChI=1S/C16H32N2/c1-13-7-6-10-16(11-13,18(3)4)12-17-15-9-5-8-14(15)2/h13-15,17H,5-12H2,1-4H3
InChIKeyWLICQFNSDLNTEQ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine (CID 65045533) is N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine is CC1CCCC(CNC2CCCC2C)(N(C)C)C1.
What is the InChIKey of N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is WLICQFNSDLNTEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-13-7-6-10-16(11-13,18(3)4)12-17-15-9-5-8-14(15)2/h13-15,17H,5-12H2,1-4H3.
What are the key properties of N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine?
N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-1-[[(2-methylcyclopentyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 65045533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).