(2R)-2-(2-methylpropyl)butanediamide

C8H16N2O2 — CID 22942178

IUPAC(2R)-2-(2-methylpropyl)butanediamide
SMILESCC(C)C[C@H](CC(N)=O)C(N)=O
InChIInChI=1S/C8H16N2O2/c1-5(2)3-6(8(10)12)4-7(9)11/h5-6H,3-4H2,1-2H3,(H2,9,11)(H2,10,12)/t6-/m1/s1
InChIKeyHYTRPVGFDDJCGM-ZCFIWIBFSA-N
MW172.23 g/mol
LogP0.01
Rot. Bonds5

About (2R)-2-(2-methylpropyl)butanediamide

(2R)-2-(2-methylpropyl)butanediamide (PubChem CID 22942178) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is (2R)-2-(2-methylpropyl)butanediamide.

Molecular Properties

Compound Name(2R)-2-(2-methylpropyl)butanediamide
PubChem CID22942178
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name(2R)-2-(2-methylpropyl)butanediamide
SMILESCC(C)C[C@H](CC(N)=O)C(N)=O
InChIInChI=1S/C8H16N2O2/c1-5(2)3-6(8(10)12)4-7(9)11/h5-6H,3-4H2,1-2H3,(H2,9,11)(H2,10,12)/t6-/m1/s1
InChIKeyHYTRPVGFDDJCGM-ZCFIWIBFSA-N
XLogP0.01
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-3-(2-methylpropyl)hexanamide
CID 87709322
3-methylbutanamide
CID 87933309
(2R)-2-[(hydroxyamino)methyl]-4-methylpentanamide
CID 138646776
2-(aminomethyl)butanediamide
CID 20502890
2-(2,2-dimethylpropyl)butanediamide
CID 88719248
2,8-dimethyl-4,6-bis(2-methylpropyl)nonan-5-one
CID 174839184
azanium (3R)-3-(2-amino-2-oxoethyl)-5-methylhexanoate
CID 23653061
3-(ethylamino)-5-methylhexanamide
CID 64989014
[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium
CID 7271814
2-chloro-4-methylpentanamide
CID 62224745
(2S)-6,6-dimethyl-2-(2-methylpropyl)-5-oxooctanamide
CID 159888064
2-(cyclopropylmethyl)butanediamide
CID 21468650

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-methylpropyl)butanediamide?
The IUPAC name of (2R)-2-(2-methylpropyl)butanediamide (CID 22942178) is (2R)-2-(2-methylpropyl)butanediamide.
What is the SMILES notation for (2R)-2-(2-methylpropyl)butanediamide?
The canonical SMILES for (2R)-2-(2-methylpropyl)butanediamide is CC(C)C[C@H](CC(N)=O)C(N)=O.
What is the InChIKey of (2R)-2-(2-methylpropyl)butanediamide?
The InChIKey is HYTRPVGFDDJCGM-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-5(2)3-6(8(10)12)4-7(9)11/h5-6H,3-4H2,1-2H3,(H2,9,11)(H2,10,12)/t6-/m1/s1.
What are the key properties of (2R)-2-(2-methylpropyl)butanediamide?
(2R)-2-(2-methylpropyl)butanediamide has a molecular weight of 172.23 g/mol, XLogP of 0.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-methylpropyl)butanediamide is sourced from PubChem (CID 22942178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).