N-cyclopropyl-2-(3-hydroxybutylamino)acetamide

C9H18N2O2 — CID 64912481

IUPACN-cyclopropyl-2-(3-hydroxybutylamino)acetamide
SMILESCC(O)CCNCC(=O)NC1CC1
InChIInChI=1S/C9H18N2O2/c1-7(12)4-5-10-6-9(13)11-8-2-3-8/h7-8,10,12H,2-6H2,1H3,(H,11,13)
InChIKeyABKULXRGZOLYSG-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.37
Rot. Bonds6

About N-cyclopropyl-2-(3-hydroxybutylamino)acetamide

N-cyclopropyl-2-(3-hydroxybutylamino)acetamide (PubChem CID 64912481) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-cyclopropyl-2-(3-hydroxybutylamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3-hydroxybutylamino)acetamide
PubChem CID64912481
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-cyclopropyl-2-(3-hydroxybutylamino)acetamide
SMILESCC(O)CCNCC(=O)NC1CC1
InChIInChI=1S/C9H18N2O2/c1-7(12)4-5-10-6-9(13)11-8-2-3-8/h7-8,10,12H,2-6H2,1H3,(H,11,13)
InChIKeyABKULXRGZOLYSG-UHFFFAOYSA-N
XLogP-0.37
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.37
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-cyclopentyl-2-(4-hydroxypentylamino)acetamide
CID 106131018
N-cyclopropyl-2-(2-propan-2-yloxyethylamino)acetamide
CID 60697253
N-(4-methylcyclohexyl)-2-(propylamino)acetamide
CID 60671942
N-cyclopropyl-3-[[2-(3-methylbutylamino)-2-oxoethyl]amino]propanamide
CID 79394037
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
N-cyclopropyl-2-(2-methylsulfonylethylamino)acetamide
CID 60915783
2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide
CID 113268578
N-cyclopropyl-3-[[2-oxo-2-(pentan-2-ylamino)ethyl]amino]propanamide
CID 79394119
2-(3-aminopropylamino)-N-cyclopropylacetamide
CID 62274184
4-[[2-(cyclopropylamino)-2-oxoethyl]amino]butanoic acid
CID 43473310
2-[(3-hydroxy-4-methoxybutyl)amino]-N-(oxan-4-yl)acetamide
CID 106246683
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 62325687

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3-hydroxybutylamino)acetamide?
The IUPAC name of N-cyclopropyl-2-(3-hydroxybutylamino)acetamide (CID 64912481) is N-cyclopropyl-2-(3-hydroxybutylamino)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(3-hydroxybutylamino)acetamide?
The canonical SMILES for N-cyclopropyl-2-(3-hydroxybutylamino)acetamide is CC(O)CCNCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(3-hydroxybutylamino)acetamide?
The InChIKey is ABKULXRGZOLYSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7(12)4-5-10-6-9(13)11-8-2-3-8/h7-8,10,12H,2-6H2,1H3,(H,11,13).
What are the key properties of N-cyclopropyl-2-(3-hydroxybutylamino)acetamide?
N-cyclopropyl-2-(3-hydroxybutylamino)acetamide has a molecular weight of 186.25 g/mol, XLogP of -0.37, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3-hydroxybutylamino)acetamide is sourced from PubChem (CID 64912481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).