2,3-diamino-N-propan-2-ylpropanamide

C6H15N3O — CID 166956225

IUPAC2,3-diamino-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(N)CN
InChIInChI=1S/C6H15N3O/c1-4(2)9-6(10)5(8)3-7/h4-5H,3,7-8H2,1-2H3,(H,9,10)
InChIKeySPACSZHGQWBVGK-UHFFFAOYSA-N
MW145.21 g/mol
LogP-1.20
Rot. Bonds3

About 2,3-diamino-N-propan-2-ylpropanamide

2,3-diamino-N-propan-2-ylpropanamide (PubChem CID 166956225) has the molecular formula C6H15N3O and a molecular weight of 145.21 g/mol. Its IUPAC name is 2,3-diamino-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2,3-diamino-N-propan-2-ylpropanamide
PubChem CID166956225
Molecular FormulaC6H15N3O
Molecular Weight145.21 g/mol
Exact Mass145.12
IUPAC Name2,3-diamino-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(N)CN
InChIInChI=1S/C6H15N3O/c1-4(2)9-6(10)5(8)3-7/h4-5H,3,7-8H2,1-2H3,(H,9,10)
InChIKeySPACSZHGQWBVGK-UHFFFAOYSA-N
XLogP-1.20
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[[(2S)-2,3-diaminopropanoyl]amino]propanoic acid
CID 11949297
(2R)-2-[[(2R)-2,3-diaminopropanoyl]amino]propanoic acid;dihydrochloride
CID 11949294
2,3-diamino-N-[(2S)-1-oxo-1-[[(2S)-1-oxopropan-2-yl]amino]propan-2-yl]propanamide
CID 11949429
methyl (Z)-2-[[(2S)-2,3-diaminopropanoyl]amino]-5-methylhex-3-enoate
CID 163623067
(2R)-2-amino-N-[(2R)-1-aminopropan-2-yl]butanamide
CID 131206927
(2S)-2-amino-N-propan-2-yl-6-(propan-2-ylamino)hexanamide
CID 147186215
4-amino-2-methyl-N-propan-2-ylbutanamide
CID 80541541
2-amino-3-phenyl-N-propan-2-ylpropanamide
CID 15926064
2-amino-4-phenyl-N-propan-2-ylbutanamide
CID 114924577
(2S)-2-amino-N-(1,3-diaminopropan-2-yl)propanamide
CID 131850934
2-amino-N-[(2R)-1-aminopropan-2-yl]propanamide
CID 130611964
(2R)-2,3-diamino-N-[(2R)-1-oxohexan-2-yl]propanamide
CID 88560908

Frequently Asked Questions

What is the IUPAC name of 2,3-diamino-N-propan-2-ylpropanamide?
The IUPAC name of 2,3-diamino-N-propan-2-ylpropanamide (CID 166956225) is 2,3-diamino-N-propan-2-ylpropanamide.
What is the SMILES notation for 2,3-diamino-N-propan-2-ylpropanamide?
The canonical SMILES for 2,3-diamino-N-propan-2-ylpropanamide is CC(C)NC(=O)C(N)CN.
What is the InChIKey of 2,3-diamino-N-propan-2-ylpropanamide?
The InChIKey is SPACSZHGQWBVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O/c1-4(2)9-6(10)5(8)3-7/h4-5H,3,7-8H2,1-2H3,(H,9,10).
What are the key properties of 2,3-diamino-N-propan-2-ylpropanamide?
2,3-diamino-N-propan-2-ylpropanamide has a molecular weight of 145.21 g/mol, XLogP of -1.20, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diamino-N-propan-2-ylpropanamide is sourced from PubChem (CID 166956225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).