5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine

C16H32N2 — CID 106633344

IUPAC5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
SMILESCC1CCC(C(C)C)C(NCC2CCCCN2)C1
InChIInChI=1S/C16H32N2/c1-12(2)15-8-7-13(3)10-16(15)18-11-14-6-4-5-9-17-14/h12-18H,4-11H2,1-3H3
InChIKeyYMWHQCVXNXZYGA-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.18
Rot. Bonds4

About 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine

5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine (PubChem CID 106633344) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
PubChem CID106633344
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
SMILESCC1CCC(C(C)C)C(NCC2CCCCN2)C1
InChIInChI=1S/C16H32N2/c1-12(2)15-8-7-13(3)10-16(15)18-11-14-6-4-5-9-17-14/h12-18H,4-11H2,1-3H3
InChIKeyYMWHQCVXNXZYGA-UHFFFAOYSA-N
XLogP3.18
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
CID 106621811
cis-(2R,5R)-5-methyl-2-propan-2-yl-N-prop-2-ynylcyclohexan-1-amine
CID 130962040
3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106636915
(2R)-1-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propan-2-ol
CID 103906936
N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine
CID 59332807
5-methyl-N-(2-methylbutyl)-2-propan-2-ylcyclohexan-1-amine
CID 43710072
N-heptyl-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 43223218
N-benzyl-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 2728111
N-(piperidin-2-ylmethyl)ethanamine
CID 11970483
5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propan-2-ylcyclohexan-1-amine
CID 104577704
5-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-2-propan-2-ylcyclohexan-1-amine
CID 63464522
5-methyl-N-(3-methyl-2-pyrrolidin-1-ylbutyl)-2-propan-2-ylcyclohexan-1-amine
CID 43105975

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine?
The IUPAC name of 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine (CID 106633344) is 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine is CC1CCC(C(C)C)C(NCC2CCCCN2)C1.
What is the InChIKey of 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine?
The InChIKey is YMWHQCVXNXZYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12(2)15-8-7-13(3)10-16(15)18-11-14-6-4-5-9-17-14/h12-18H,4-11H2,1-3H3.
What are the key properties of 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine?
5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 106633344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).