2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide

C14H29N3O — CID 76887361

IUPAC2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
SMILESCC(C)N1CCC(NC(=O)C(N)C(C)(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-10(2)17-8-6-11(7-9-17)16-13(18)12(15)14(3,4)5/h10-12H,6-9,15H2,1-5H3,(H,16,18)
InChIKeyORIDEYVWAMPYOL-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds3

About 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide

2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide (PubChem CID 76887361) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide.

Molecular Properties

Compound Name2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
PubChem CID76887361
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
SMILESCC(C)N1CCC(NC(=O)C(N)C(C)(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-10(2)17-8-6-11(7-9-17)16-13(18)12(15)14(3,4)5/h10-12H,6-9,15H2,1-5H3,(H,16,18)
InChIKeyORIDEYVWAMPYOL-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-acetylpiperidin-4-yl)-2-amino-3,3-dimethylbutanamide
CID 68920493
(2S)-2-amino-N-cyclopropyl-3,3-dimethylbutanamide;hydrochloride
CID 66951838
2-amino-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 76887363
(2S)-2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 61179355
(2S)-2-amino-3,3-dimethyl-N-(4-propan-2-ylcyclohexyl)butanamide
CID 119812015
(2S)-2-amino-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 79024824
2-bromo-3-methyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 43700528
2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide;molecular hydrogen
CID 176982787
(2S)-2-amino-3,3-dimethyl-N-(4-methylcyclohexyl)butanamide;hydrochloride
CID 119779394
(2S)-2-amino-3,3-dimethyl-N-(thian-4-yl)butanamide
CID 103810218
3-amino-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 60842653
(2S)-2-amino-3,3-dimethyl-N-(1-propylsulfonylpiperidin-4-yl)butanamide
CID 61154783

Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide?
The IUPAC name of 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide (CID 76887361) is 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide.
What is the SMILES notation for 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide?
The canonical SMILES for 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide is CC(C)N1CCC(NC(=O)C(N)C(C)(C)C)CC1.
What is the InChIKey of 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide?
The InChIKey is ORIDEYVWAMPYOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-10(2)17-8-6-11(7-9-17)16-13(18)12(15)14(3,4)5/h10-12H,6-9,15H2,1-5H3,(H,16,18).
What are the key properties of 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide?
2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide is sourced from PubChem (CID 76887361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).