2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide

C14H27N3O — CID 120774845

IUPAC2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide
SMILESCC1(C)CN(CC(=O)NCC2CCC2)CCC1N
InChIInChI=1S/C14H27N3O/c1-14(2)10-17(7-6-12(14)15)9-13(18)16-8-11-4-3-5-11/h11-12H,3-10,15H2,1-2H3,(H,16,18)
InChIKeyRZNCLBLIAHBEDM-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.96
Rot. Bonds4

About 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide

2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide (PubChem CID 120774845) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide
PubChem CID120774845
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide
SMILESCC1(C)CN(CC(=O)NCC2CCC2)CCC1N
InChIInChI=1S/C14H27N3O/c1-14(2)10-17(7-6-12(14)15)9-13(18)16-8-11-4-3-5-11/h11-12H,3-10,15H2,1-2H3,(H,16,18)
InChIKeyRZNCLBLIAHBEDM-UHFFFAOYSA-N
XLogP0.96
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclopropylmethyl)acetamide;hydrochloride
CID 120774150
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-propan-2-ylacetamide
CID 120774308
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[[4-(methoxymethyl)phenyl]methyl]acetamide;hydrochloride
CID 120776497
2-(4-amino-3,3-dimethylpiperidin-1-yl)-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 120774690
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 120774994
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[(4-propoxyphenyl)methyl]acetamide
CID 120774187
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide;hydrochloride
CID 120774927
N-(cyclobutylmethyl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 111334071
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[[4-(trifluoromethoxy)phenyl]methyl]acetamide;hydrochloride
CID 120774148
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[[4-(phenoxymethyl)phenyl]methyl]acetamide
CID 120774440
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide
CID 120774997
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[2-(cyclohexylmethyl)pyrazol-3-yl]acetamide;dihydrochloride
CID 120775470

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide?
The IUPAC name of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide (CID 120774845) is 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide.
What is the SMILES notation for 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide?
The canonical SMILES for 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide is CC1(C)CN(CC(=O)NCC2CCC2)CCC1N.
What is the InChIKey of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide?
The InChIKey is RZNCLBLIAHBEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-14(2)10-17(7-6-12(14)15)9-13(18)16-8-11-4-3-5-11/h11-12H,3-10,15H2,1-2H3,(H,16,18).
What are the key properties of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide?
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide has a molecular weight of 253.39 g/mol, XLogP of 0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(cyclobutylmethyl)acetamide is sourced from PubChem (CID 120774845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).