N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide

C12H26N2O — CID 115737332

IUPACN-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide
SMILESCC(CN)N(C)C(=O)CC(C)C(C)(C)C
InChIInChI=1S/C12H26N2O/c1-9(12(3,4)5)7-11(15)14(6)10(2)8-13/h9-10H,7-8,13H2,1-6H3
InChIKeyUJIQKWRQSABLLH-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.86
Rot. Bonds4

About N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide

N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide (PubChem CID 115737332) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide
PubChem CID115737332
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide
SMILESCC(CN)N(C)C(=O)CC(C)C(C)(C)C
InChIInChI=1S/C12H26N2O/c1-9(12(3,4)5)7-11(15)14(6)10(2)8-13/h9-10H,7-8,13H2,1-6H3
InChIKeyUJIQKWRQSABLLH-UHFFFAOYSA-N
XLogP1.86
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Pyrrolidine, 1-[(2S,3R)-2-amino-3-methyl-1-oxopentyl]-
CID 9794073
(2S,3S)-2-amino-3-methyl-1-(pyrrolidin-1-yl)pentan-1-one
CID 9796352
Valeramide, N-(2-(dimethylamino)ethyl)-2-propyl-
CID 200807
2-Amino-3-methyl-1-pyrrolidin-1-yl-pentan-1-one
CID 10130255
3-(Carboxyamide(2-carboxyamide-2-tertbutylethyl))pentan
CID 5289290
(2S,3S)-2-Amino-N,N,3-trimethylpentanamide
CID 10678522
(2S,3S)-2-amino-3-methyl-1-(piperidin-1-yl)pentan-1-one
CID 10821833
(S)-2-amino-4-methyl-1-(pyrrolidin-1-yl)pentan-1-one
CID 22690988
3-Methyl-1-oxo-1-piperidin-1-ylpentan-2-aminium
CID 24692381
Valeramide, N-(2-(diethylamino)ethyl)-2-propyl-
CID 200808
2-amino-N,N,4-trimethylpentanamide hydrochloride
CID 42944933
2-Amino-1-azetidin-1-yl-3-methyl-pentan-1-one
CID 9964212

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide?
The IUPAC name of N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide (CID 115737332) is N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide is CC(CN)N(C)C(=O)CC(C)C(C)(C)C.
What is the InChIKey of N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide?
The InChIKey is UJIQKWRQSABLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9(12(3,4)5)7-11(15)14(6)10(2)8-13/h9-10H,7-8,13H2,1-6H3.
What are the key properties of N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide?
N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide has a molecular weight of 214.35 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-N,3,4,4-tetramethylpentanamide is sourced from PubChem (CID 115737332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).