3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide

C10H20N2O2 — CID 115927783

IUPAC3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide
SMILESCC(CC(N)=O)NC(C)(CO)C1CC1
InChIInChI=1S/C10H20N2O2/c1-7(5-9(11)14)12-10(2,6-13)8-3-4-8/h7-8,12-13H,3-6H2,1-2H3,(H2,11,14)
InChIKeyQASFKUVJTZGAFW-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.00
Rot. Bonds6

About 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide

3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide (PubChem CID 115927783) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide.

Molecular Properties

Compound Name3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide
PubChem CID115927783
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide
SMILESCC(CC(N)=O)NC(C)(CO)C1CC1
InChIInChI=1S/C10H20N2O2/c1-7(5-9(11)14)12-10(2,6-13)8-3-4-8/h7-8,12-13H,3-6H2,1-2H3,(H2,11,14)
InChIKeyQASFKUVJTZGAFW-UHFFFAOYSA-N
XLogP0.00
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-(hexan-2-ylamino)propan-1-ol
CID 115927781
3-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
CID 115746838
1-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-3-[(2S)-1-cyclopropylpropan-2-yl]urea
CID 97321327
3-(2-cyclobutylethylamino)butanamide
CID 115893474
2-(2-cyclopropylpropan-2-ylamino)propanamide
CID 104577813
3-(cyclobutylmethylamino)butanamide
CID 115676578
2-cyclopropyl-2-(3-methylbutylamino)propan-1-ol
CID 75453473
CID 178036338
CID 178036338
3-(4-tert-butylcyclohexyl)-3-(methylamino)propanamide
CID 104576070
2-cyclopropyl-2-(1-methoxybutan-2-ylamino)propan-1-ol
CID 115927778
3-[(4-hydroxycyclohexyl)amino]butanamide
CID 45281355
(3R)-N-[(2R)-2-cyclohexyl-1-hydroxypropan-2-yl]-3-hydroxy-4-methylpentanamide
CID 99704485

Frequently Asked Questions

What is the IUPAC name of 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide?
The IUPAC name of 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide (CID 115927783) is 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide.
What is the SMILES notation for 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide?
The canonical SMILES for 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide is CC(CC(N)=O)NC(C)(CO)C1CC1.
What is the InChIKey of 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide?
The InChIKey is QASFKUVJTZGAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(5-9(11)14)12-10(2,6-13)8-3-4-8/h7-8,12-13H,3-6H2,1-2H3,(H2,11,14).
What are the key properties of 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide?
3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide has a molecular weight of 200.28 g/mol, XLogP of 0.00, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]butanamide is sourced from PubChem (CID 115927783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).