N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide

C8H18N2O2 — CID 60841467

IUPACN-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide
SMILESCC(C)NCC(=O)NC(C)CO
InChIInChI=1S/C8H18N2O2/c1-6(2)9-4-8(12)10-7(3)5-11/h6-7,9,11H,4-5H2,1-3H3,(H,10,12)
InChIKeyPGUREXUOMGCPJZ-UHFFFAOYSA-N
MW174.24 g/mol
LogP-0.52
Rot. Bonds5

About N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide

N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide (PubChem CID 60841467) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide
PubChem CID60841467
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC NameN-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide
SMILESCC(C)NCC(=O)NC(C)CO
InChIInChI=1S/C8H18N2O2/c1-6(2)9-4-8(12)10-7(3)5-11/h6-7,9,11H,4-5H2,1-3H3,(H,10,12)
InChIKeyPGUREXUOMGCPJZ-UHFFFAOYSA-N
XLogP-0.52
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxybutan-2-yl)-2-(propan-2-ylamino)acetamide
CID 83176839
3-[[2-(propan-2-ylamino)acetyl]amino]butanoic acid
CID 61160050
N-(4-methoxybutan-2-yl)-2-(propan-2-ylamino)acetamide
CID 64605255
2-(tert-butylamino)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 107218468
1-[(2S)-1-hydroxypropan-2-yl]-3-propan-2-ylurea
CID 79023677
2-amino-N-[(2S)-1-hydroxypropan-2-yl]acetamide
CID 93083458
2-chloro-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 55298424
2-(cyclopropylmethylamino)-N-(1-hydroxypropan-2-yl)acetamide
CID 60841587
N-[(2R)-1-hydroxypropan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 107218513
2-anilino-N-(1-hydroxypropan-2-yl)acetamide
CID 60862778
2-cyclopropyl-2-[[2-(propan-2-ylamino)acetyl]amino]acetic acid
CID 62696018
3-amino-N-[(2R)-1-hydroxypropan-2-yl]propanamide
CID 93083457

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide (CID 60841467) is N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide is CC(C)NCC(=O)NC(C)CO.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide?
The InChIKey is PGUREXUOMGCPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-6(2)9-4-8(12)10-7(3)5-11/h6-7,9,11H,4-5H2,1-3H3,(H,10,12).
What are the key properties of N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide?
N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide has a molecular weight of 174.24 g/mol, XLogP of -0.52, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-2-(propan-2-ylamino)acetamide is sourced from PubChem (CID 60841467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).