N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide

C10H22N2O2 — CID 60671634

IUPACN-butyl-2-(1-hydroxybutan-2-ylamino)acetamide
SMILESCCCCNC(=O)CNC(CC)CO
InChIInChI=1S/C10H22N2O2/c1-3-5-6-11-10(14)7-12-9(4-2)8-13/h9,12-13H,3-8H2,1-2H3,(H,11,14)
InChIKeyRANHNHRQISXABB-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.26
Rot. Bonds8

About N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide

N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide (PubChem CID 60671634) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-butyl-2-(1-hydroxybutan-2-ylamino)acetamide
PubChem CID60671634
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC NameN-butyl-2-(1-hydroxybutan-2-ylamino)acetamide
SMILESCCCCNC(=O)CNC(CC)CO
InChIInChI=1S/C10H22N2O2/c1-3-5-6-11-10(14)7-12-9(4-2)8-13/h9,12-13H,3-8H2,1-2H3,(H,11,14)
InChIKeyRANHNHRQISXABB-UHFFFAOYSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-2-(octan-4-ylamino)acetamide
CID 106024887
N-(cyanomethyl)-2-(1-hydroxybutan-2-ylamino)acetamide
CID 43499785
1-butyl-3-(1-hydroxybutan-2-yl)urea
CID 43393019
2-(1,3-dihydroxypropan-2-ylamino)-N-pentan-3-ylacetamide
CID 65313831
N-(3-methylbutyl)-2-(pentan-3-ylamino)acetamide
CID 60672078
N-ethyl-2-(pentan-3-ylamino)acetamide
CID 28566551
(2S)-2-(pentylamino)butan-1-ol
CID 28724748
N-butyl-2-[(2-hydroxy-1-phenylethyl)amino]acetamide
CID 63182961
N-(1-hydroxybutan-2-yl)pentanamide
CID 43417907
N-butyl-2-(1-methoxypropan-2-ylamino)acetamide
CID 60672222
2-(decylamino)butan-1-ol
CID 60668820
N-[(2S)-1-hydroxybutan-2-yl]hexanamide
CID 104981701

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide?
The IUPAC name of N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide (CID 60671634) is N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide.
What is the SMILES notation for N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide?
The canonical SMILES for N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide is CCCCNC(=O)CNC(CC)CO.
What is the InChIKey of N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide?
The InChIKey is RANHNHRQISXABB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-3-5-6-11-10(14)7-12-9(4-2)8-13/h9,12-13H,3-8H2,1-2H3,(H,11,14).
What are the key properties of N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide?
N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide has a molecular weight of 202.30 g/mol, XLogP of 0.26, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(1-hydroxybutan-2-ylamino)acetamide is sourced from PubChem (CID 60671634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).