N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide

C15H29N3O — CID 43435274

IUPACN-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(NC2CCCC(C)C2)CC1
InChIInChI=1S/C15H29N3O/c1-12-4-3-5-14(10-12)17-13-6-8-18(9-7-13)11-15(19)16-2/h12-14,17H,3-11H2,1-2H3,(H,16,19)
InChIKeyGCVSXZGYQSWQKK-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.37
Rot. Bonds4

About N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide

N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide (PubChem CID 43435274) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide
PubChem CID43435274
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(NC2CCCC(C)C2)CC1
InChIInChI=1S/C15H29N3O/c1-12-4-3-5-14(10-12)17-13-6-8-18(9-7-13)11-15(19)16-2/h12-14,17H,3-11H2,1-2H3,(H,16,19)
InChIKeyGCVSXZGYQSWQKK-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide?
The IUPAC name of N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide (CID 43435274) is N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide is CNC(=O)CN1CCC(NC2CCCC(C)C2)CC1.
What is the InChIKey of N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide?
The InChIKey is GCVSXZGYQSWQKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-4-3-5-14(10-12)17-13-6-8-18(9-7-13)11-15(19)16-2/h12-14,17H,3-11H2,1-2H3,(H,16,19).
What are the key properties of N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide?
N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 43435274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).