2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride

C10H20ClN3O2 — CID 119957385

IUPAC2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride
SMILESCC(CC1CC1)NC(=O)C(N)CC(N)=O.Cl
InChIInChI=1S/C10H19N3O2.ClH/c1-6(4-7-2-3-7)13-10(15)8(11)5-9(12)14;/h6-8H,2-5,11H2,1H3,(H2,12,14)(H,13,15);1H
InChIKeyOZNBWOIVKNJYPS-UHFFFAOYSA-N
MW249.74 g/mol
LogP-0.08
Rot. Bonds6

About 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride

2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride (PubChem CID 119957385) has the molecular formula C10H20ClN3O2 and a molecular weight of 249.74 g/mol. Its IUPAC name is 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride
PubChem CID119957385
Molecular FormulaC10H20ClN3O2
Molecular Weight249.74 g/mol
Exact Mass249.12
IUPAC Name2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride
SMILESCC(CC1CC1)NC(=O)C(N)CC(N)=O.Cl
InChIInChI=1S/C10H19N3O2.ClH/c1-6(4-7-2-3-7)13-10(15)8(11)5-9(12)14;/h6-8H,2-5,11H2,1H3,(H2,12,14)(H,13,15);1H
InChIKeyOZNBWOIVKNJYPS-UHFFFAOYSA-N
XLogP-0.08
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(4-amino-4-oxobutan-2-yl)-4-methylpentanamide
CID 103812202
(2R)-2-amino-N-(1-cyclopropylpropan-2-yl)-3,3-dimethylbutanamide
CID 103929976
N-(1-cyclopropylpropan-2-yl)-2-sulfanylpropanamide
CID 107030339
(2S)-2-amino-N-(1-cyclopropylpropan-2-yl)-3-phenylpropanamide
CID 78955758
2-amino-N-(1-cyclopropylpropan-2-yl)-2-phenylacetamide;hydrochloride
CID 119324224
3-amino-N-(1-cyclopropylpropan-2-yl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119784591
2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide
CID 60848182
3-[(3-cyclopentyl-2-hydroxypropyl)amino]butanamide
CID 103158365
2-[2-[(2,4-diamino-4-oxobutanoyl)amino]propanoylamino]propanoic acid
CID 18218968
2-amino-N-[2-(cyclopropylmethoxy)ethyl]butanediamide
CID 103827564
3-amino-4-(1-carboxypropan-2-ylamino)-4-oxobutanoic acid
CID 64895941
3-(1-cyclopropylpropan-2-ylamino)-3-oxopropanoic acid
CID 63994028

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride?
The IUPAC name of 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride (CID 119957385) is 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride?
The canonical SMILES for 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride is CC(CC1CC1)NC(=O)C(N)CC(N)=O.Cl.
What is the InChIKey of 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride?
The InChIKey is OZNBWOIVKNJYPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2.ClH/c1-6(4-7-2-3-7)13-10(15)8(11)5-9(12)14;/h6-8H,2-5,11H2,1H3,(H2,12,14)(H,13,15);1H.
What are the key properties of 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride?
2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride has a molecular weight of 249.74 g/mol, XLogP of -0.08, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride is sourced from PubChem (CID 119957385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).