(2S)-2-(tert-butylamino)propanamide

C7H16N2O — CID 122595245

IUPAC(2S)-2-(tert-butylamino)propanamide
SMILESC[C@H](NC(C)(C)C)C(N)=O
InChIInChI=1S/C7H16N2O/c1-5(6(8)10)9-7(2,3)4/h5,9H,1-4H3,(H2,8,10)/t5-/m0/s1
InChIKeyDLASSARZJSLSFO-YFKPBYRVSA-N
MW144.22 g/mol
LogP0.25
Rot. Bonds2

About (2S)-2-(tert-butylamino)propanamide

(2S)-2-(tert-butylamino)propanamide (PubChem CID 122595245) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is (2S)-2-(tert-butylamino)propanamide.

Molecular Properties

Compound Name(2S)-2-(tert-butylamino)propanamide
PubChem CID122595245
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name(2S)-2-(tert-butylamino)propanamide
SMILESC[C@H](NC(C)(C)C)C(N)=O
InChIInChI=1S/C7H16N2O/c1-5(6(8)10)9-7(2,3)4/h5,9H,1-4H3,(H2,8,10)/t5-/m0/s1
InChIKeyDLASSARZJSLSFO-YFKPBYRVSA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(tert-butylamino)-4-methylpentan-3-one
CID 134376563
2-(2-cyclopropylpropan-2-ylamino)propanamide
CID 104577813
2-[[2-methyl-4-(methylamino)-3-oxobutan-2-yl]amino]propanamide
CID 166851139
2-(hydroxyamino)propanamide
CID 12611671
(2R)-2-(tert-butylamino)-3-hydroxypropanamide
CID 87261665
methyl 3-(tert-butylamino)-2-methylidenebutanoate;2-methylprop-2-enamide
CID 174514180
(2R)-2-[[(2S)-2-(tert-butylamino)propanoyl]amino]propanoic acid
CID 130454125
(2R)-2-(tert-butylamino)-N-ethylpropanamide
CID 146263926
2-(methylamino)propanamide;hydrochloride
CID 71433439
tert-butyl N-[(2S)-1-amino-1-oxopropan-2-yl]carbamate
CID 7015295
2-amino-N-(1-amino-1-oxopropan-2-yl)-3,3-dimethylbutanamide
CID 76893601
2-[3-(tert-butylamino)propanoylamino]propanamide
CID 60850067

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(tert-butylamino)propanamide?
The IUPAC name of (2S)-2-(tert-butylamino)propanamide (CID 122595245) is (2S)-2-(tert-butylamino)propanamide.
What is the SMILES notation for (2S)-2-(tert-butylamino)propanamide?
The canonical SMILES for (2S)-2-(tert-butylamino)propanamide is C[C@H](NC(C)(C)C)C(N)=O.
What is the InChIKey of (2S)-2-(tert-butylamino)propanamide?
The InChIKey is DLASSARZJSLSFO-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H16N2O/c1-5(6(8)10)9-7(2,3)4/h5,9H,1-4H3,(H2,8,10)/t5-/m0/s1.
What are the key properties of (2S)-2-(tert-butylamino)propanamide?
(2S)-2-(tert-butylamino)propanamide has a molecular weight of 144.22 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(tert-butylamino)propanamide is sourced from PubChem (CID 122595245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).