N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine

C17H34N2 — CID 106622647

IUPACN-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
SMILESCCN(CC1CCCCN1)C1CCC(C)(C)CC1C
InChIInChI=1S/C17H34N2/c1-5-19(13-15-8-6-7-11-18-15)16-9-10-17(3,4)12-14(16)2/h14-16,18H,5-13H2,1-4H3
InChIKeyMZNILUVZFAAVQX-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds4

About N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine

N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine (PubChem CID 106622647) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
PubChem CID106622647
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
SMILESCCN(CC1CCCCN1)C1CCC(C)(C)CC1C
InChIInChI=1S/C17H34N2/c1-5-19(13-15-8-6-7-11-18-15)16-9-10-17(3,4)12-14(16)2/h14-16,18H,5-13H2,1-4H3
InChIKeyMZNILUVZFAAVQX-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2,3-dimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
CID 106622517
2-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106604021
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
N,3,3-trimethyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106602628
4,4-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622300
N-(azepan-2-ylmethyl)-N-ethylethanamine
CID 4715268
N-ethyl-N-(2,4,4-trimethylcyclohexyl)piperidin-3-amine
CID 81320842
2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine
CID 106623281
N-cyclopropyl-2-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106599133
N-ethyl-N-(piperidin-2-ylmethyl)-6-oxa-2-thiaspiro[4.5]decan-9-amine
CID 106632717
trans-(1R,2R)-N,N-diethyl-2-methylcyclohexan-1-amine
CID 15852265
N-ethyl-1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 106828141

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine (CID 106622647) is N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine is CCN(CC1CCCCN1)C1CCC(C)(C)CC1C.
What is the InChIKey of N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is MZNILUVZFAAVQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-5-19(13-15-8-6-7-11-18-15)16-9-10-17(3,4)12-14(16)2/h14-16,18H,5-13H2,1-4H3.
What are the key properties of N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 106622647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).