1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide

C14H27N3O2 — CID 119653194

IUPAC1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide
SMILESCC(=O)N1CCCC(C(=O)N(C)CC(C)(C)CN)C1
InChIInChI=1S/C14H27N3O2/c1-11(18)17-7-5-6-12(8-17)13(19)16(4)10-14(2,3)9-15/h12H,5-10,15H2,1-4H3
InChIKeyFVRSVVKDXGHTIU-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.69
Rot. Bonds4

About 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide

1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide (PubChem CID 119653194) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide
PubChem CID119653194
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide
SMILESCC(=O)N1CCCC(C(=O)N(C)CC(C)(C)CN)C1
InChIInChI=1S/C14H27N3O2/c1-11(18)17-7-5-6-12(8-17)13(19)16(4)10-14(2,3)9-15/h12H,5-10,15H2,1-4H3
InChIKeyFVRSVVKDXGHTIU-UHFFFAOYSA-N
XLogP0.69
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
CID 119656331
3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide
CID 119654700
N-(3-amino-2,2-dimethylpropyl)-N-methylpyrrolidine-1-carboxamide
CID 79652128
N-(3-amino-2,2-dimethylpropyl)-1-[2-(difluoromethoxy)benzoyl]-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119652684
2-[(1-acetylpiperidine-3-carbonyl)-tert-butylamino]acetic acid
CID 79265924
1-acetyl-N-benzyl-N-methylpiperidine-3-carboxamide
CID 110686080
1-acetyl-N-(2-hydroxy-3-methoxypropyl)-N-methylpiperidine-3-carboxamide
CID 54993733
1-acetyl-N-[(4-hydroxyoxan-4-yl)methyl]-N-methylpiperidine-3-carboxamide
CID 114951241
1-acetyl-N,N-dimethylpyrrolidine-3-carboxamide
CID 130660566
N-(3-amino-2,2-dimethylpropyl)-N-methylthiane-2-carboxamide
CID 80594937
1-acetylpiperidine-3-carboxylic acid
CID 14043896
N,N-dimethyl-1-prop-1-en-2-ylpiperidine-3-carboxamide;ethane
CID 177327317

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide (CID 119653194) is 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide is CC(=O)N1CCCC(C(=O)N(C)CC(C)(C)CN)C1.
What is the InChIKey of 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is FVRSVVKDXGHTIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-11(18)17-7-5-6-12(8-17)13(19)16(4)10-14(2,3)9-15/h12H,5-10,15H2,1-4H3.
What are the key properties of 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide?
1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 119653194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).