2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide

C5H10ClNO2 — CID 55298424

IUPAC2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide
SMILESC[C@H](CO)NC(=O)CCl
InChIInChI=1S/C5H10ClNO2/c1-4(3-8)7-5(9)2-6/h4,8H,2-3H2,1H3,(H,7,9)/t4-/m1/s1
InChIKeyCHFSJZZCPILTEV-SCSAIBSYSA-N
MW151.59 g/mol
LogP-0.28
Rot. Bonds3

About 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide

2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide (PubChem CID 55298424) has the molecular formula C5H10ClNO2 and a molecular weight of 151.59 g/mol. Its IUPAC name is 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide
PubChem CID55298424
Molecular FormulaC5H10ClNO2
Molecular Weight151.59 g/mol
Exact Mass151.04
IUPAC Name2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide
SMILESC[C@H](CO)NC(=O)CCl
InChIInChI=1S/C5H10ClNO2/c1-4(3-8)7-5(9)2-6/h4,8H,2-3H2,1H3,(H,7,9)/t4-/m1/s1
InChIKeyCHFSJZZCPILTEV-SCSAIBSYSA-N
XLogP-0.28
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.59
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-[(2S)-4-hydroxybutan-2-yl]acetamide
CID 155389000
2-chloro-N-[4-[(2-chloroacetyl)amino]pentan-2-yl]acetamide
CID 87981003
2-chloro-N-(1-hydroxy-3-methylbutan-2-yl)acetamide
CID 79249423
2-chloro-N-[1-[2-[(2-chloroacetyl)amino]propoxy]propan-2-yl]acetamide
CID 162712779
2-chloro-N-[1-(dimethylamino)propan-2-yl]acetamide
CID 82945659
5-chloro-N-(1-hydroxypropan-2-yl)pentanamide
CID 61251203
2-amino-N-[(2S)-1-hydroxypropan-2-yl]acetamide
CID 93083458
2-chloro-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 12032305
4-[[(2R)-1-hydroxypropan-2-yl]amino]-4-oxobutanoic acid
CID 107214433
3-amino-N-[(2R)-1-hydroxypropan-2-yl]propanamide
CID 93083457
N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide
CID 60841467
2-chloro-N-(4-methylsulfinylbutan-2-yl)acetamide
CID 115879988

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide?
The IUPAC name of 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide (CID 55298424) is 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide.
What is the SMILES notation for 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide?
The canonical SMILES for 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide is C[C@H](CO)NC(=O)CCl.
What is the InChIKey of 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide?
The InChIKey is CHFSJZZCPILTEV-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H10ClNO2/c1-4(3-8)7-5(9)2-6/h4,8H,2-3H2,1H3,(H,7,9)/t4-/m1/s1.
What are the key properties of 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide?
2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide has a molecular weight of 151.59 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide is sourced from PubChem (CID 55298424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).