2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide

C8H18N2O3 — CID 106190418

IUPAC2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide
SMILESCNC(=O)C(C)NC(CO)COC
InChIInChI=1S/C8H18N2O3/c1-6(8(12)9-2)10-7(4-11)5-13-3/h6-7,10-11H,4-5H2,1-3H3,(H,9,12)
InChIKeyRSWLPQKLHUWKIK-UHFFFAOYSA-N
MW190.24 g/mol
LogP-1.28
Rot. Bonds6

About 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide

2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide (PubChem CID 106190418) has the molecular formula C8H18N2O3 and a molecular weight of 190.24 g/mol. Its IUPAC name is 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide
PubChem CID106190418
Molecular FormulaC8H18N2O3
Molecular Weight190.24 g/mol
Exact Mass190.13
IUPAC Name2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide
SMILESCNC(=O)C(C)NC(CO)COC
InChIInChI=1S/C8H18N2O3/c1-6(8(12)9-2)10-7(4-11)5-13-3/h6-7,10-11H,4-5H2,1-3H3,(H,9,12)
InChIKeyRSWLPQKLHUWKIK-UHFFFAOYSA-N
XLogP-1.28
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]propanoate
CID 106187566
2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-(2-methylpropyl)propanamide
CID 106190666
N-(ethylcarbamoyl)-2-[(1-hydroxy-3-methoxypropan-2-yl)amino]propanamide
CID 106190668
(2S)-3-methoxy-2-(propan-2-ylamino)propan-1-ol
CID 130685651
3-[(1-hydroxy-3-methoxypropan-2-yl)amino]butanoic acid
CID 106190646
N'-hydroxy-2-[(1-hydroxy-3-methoxypropan-2-yl)amino]propanimidamide
CID 106189728
2-[(1-hydroxy-3-methoxypropan-2-yl)amino]butanoic acid
CID 106187891
N-butyl-2-[(1-hydroxy-4-methoxybutan-2-yl)amino]propanamide
CID 114210564
2-bromo-N-(1-hydroxy-3-methoxypropan-2-yl)-3-methylbutanamide
CID 106186138
2-[(1-hydroxy-3-methoxypropan-2-yl)amino]pentanoic acid
CID 106190511
(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide
CID 103931984
(2S)-2-(1,3-dihydroxypropan-2-ylamino)propanoic acid
CID 139900903

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide?
The IUPAC name of 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide (CID 106190418) is 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide.
What is the SMILES notation for 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide?
The canonical SMILES for 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide is CNC(=O)C(C)NC(CO)COC.
What is the InChIKey of 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide?
The InChIKey is RSWLPQKLHUWKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3/c1-6(8(12)9-2)10-7(4-11)5-13-3/h6-7,10-11H,4-5H2,1-3H3,(H,9,12).
What are the key properties of 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide?
2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide has a molecular weight of 190.24 g/mol, XLogP of -1.28, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxy-3-methoxypropan-2-yl)amino]-N-methylpropanamide is sourced from PubChem (CID 106190418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).