2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide

C16H31N3O — CID 79992651

IUPAC2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide
SMILESCCN(C(=O)CN1CC(C)CC(N)C1)C1CCCCC1
InChIInChI=1S/C16H31N3O/c1-3-19(15-7-5-4-6-8-15)16(20)12-18-10-13(2)9-14(17)11-18/h13-15H,3-12,17H2,1-2H3
InChIKeyQSEAZFLGHKNWCE-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.84
Rot. Bonds4

About 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide

2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide (PubChem CID 79992651) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide.

Molecular Properties

Compound Name2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide
PubChem CID79992651
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide
SMILESCCN(C(=O)CN1CC(C)CC(N)C1)C1CCCCC1
InChIInChI=1S/C16H31N3O/c1-3-19(15-7-5-4-6-8-15)16(20)12-18-10-13(2)9-14(17)11-18/h13-15H,3-12,17H2,1-2H3
InChIKeyQSEAZFLGHKNWCE-UHFFFAOYSA-N
XLogP1.84
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 79993534
2-(3-aminopyrrolidin-1-yl)-N-cyclohexyl-N-ethylacetamide;hydrochloride
CID 119917689
2-(3-amino-5-methylpiperidin-1-yl)-N-(cyclopenten-1-yl)-N-ethylacetamide
CID 79994189
N-cyclohexyl-N-ethyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
CID 60689929
N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 119928234
2-(3-amino-5-methylpiperidin-1-yl)-N-(cyclohexen-1-yl)-N-ethylacetamide
CID 79994225
2-[2-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclohexyl-N-ethylacetamide
CID 103441903
N-cyclopentyl-N-ethyl-2-piperazin-1-ylacetamide
CID 43541539
N-cyclohexyl-N-ethyl-2-[3-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119914794
N-cyclohexyl-2-(1,4-diazepan-1-yl)-N-ethylacetamide;hydrochloride
CID 119906882
2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopropyl-N-ethylacetamide
CID 61488497
3-amino-N-cyclohexyl-N-ethylpropanamide
CID 16786481

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide?
The IUPAC name of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide (CID 79992651) is 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide.
What is the SMILES notation for 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide?
The canonical SMILES for 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide is CCN(C(=O)CN1CC(C)CC(N)C1)C1CCCCC1.
What is the InChIKey of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide?
The InChIKey is QSEAZFLGHKNWCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-3-19(15-7-5-4-6-8-15)16(20)12-18-10-13(2)9-14(17)11-18/h13-15H,3-12,17H2,1-2H3.
What are the key properties of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide?
2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide has a molecular weight of 281.44 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide is sourced from PubChem (CID 79992651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).