N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide

C15H29N3O — CID 83997579

IUPACN-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CC(C)CC(NCC2CCC2)C1
InChIInChI=1S/C15H29N3O/c1-12-8-15(17-9-14-4-3-5-14)11-18(10-12)7-6-16-13(2)19/h12,14-15,17H,3-11H2,1-2H3,(H,16,19)
InChIKeyFRMNEFGXGQQTCY-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.22
Rot. Bonds6

About N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide

N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide (PubChem CID 83997579) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide
PubChem CID83997579
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CC(C)CC(NCC2CCC2)C1
InChIInChI=1S/C15H29N3O/c1-12-8-15(17-9-14-4-3-5-14)11-18(10-12)7-6-16-13(2)19/h12,14-15,17H,3-11H2,1-2H3,(H,16,19)
InChIKeyFRMNEFGXGQQTCY-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[3-(cyclopentylmethylamino)-5-ethylpiperidin-1-yl]ethyl]acetamide
CID 83998272
N-[2-[3-methyl-5-(methylamino)piperidin-1-yl]ethyl]acetamide
CID 83990134
N-[2-[3-(cyclopentylmethylamino)piperidin-1-yl]ethyl]acetamide
CID 83998270
N-[2-[3-(cyclohexylmethylamino)piperidin-1-yl]ethyl]acetamide
CID 83998962
N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide
CID 79993303
2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetamide
CID 83998206
3-(cyclobutylmethylamino)-5-methylpiperidine-1-carboxamide
CID 83997098
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide
CID 70842274
tert-butyl 2-[3-(cyclopentylmethylamino)-5-methylpiperidin-1-yl]acetate
CID 83998177
N-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]acetamide
CID 126999485
N-(cyclopentylmethyl)-5-methyl-1-(2-methylpropyl)piperidin-3-amine
CID 83997686
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997328

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide (CID 83997579) is N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide is CC(=O)NCCN1CC(C)CC(NCC2CCC2)C1.
What is the InChIKey of N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide?
The InChIKey is FRMNEFGXGQQTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-8-15(17-9-14-4-3-5-14)11-18(10-12)7-6-16-13(2)19/h12,14-15,17H,3-11H2,1-2H3,(H,16,19).
What are the key properties of N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide?
N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(cyclobutylmethylamino)-5-methylpiperidin-1-yl]ethyl]acetamide is sourced from PubChem (CID 83997579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).