N-butyl-2-(cyclopropylamino)acetamide

C9H18N2O — CID 54773122

IUPACN-butyl-2-(cyclopropylamino)acetamide
SMILESCCCCNC(=O)CNC1CC1
InChIInChI=1S/C9H18N2O/c1-2-3-6-10-9(12)7-11-8-4-5-8/h8,11H,2-7H2,1H3,(H,10,12)
InChIKeyGAFXBGIESFDCCC-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.65
Rot. Bonds6

About N-butyl-2-(cyclopropylamino)acetamide

N-butyl-2-(cyclopropylamino)acetamide (PubChem CID 54773122) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-butyl-2-(cyclopropylamino)acetamide.

Molecular Properties

Compound NameN-butyl-2-(cyclopropylamino)acetamide
PubChem CID54773122
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-butyl-2-(cyclopropylamino)acetamide
SMILESCCCCNC(=O)CNC1CC1
InChIInChI=1S/C9H18N2O/c1-2-3-6-10-9(12)7-11-8-4-5-8/h8,11H,2-7H2,1H3,(H,10,12)
InChIKeyGAFXBGIESFDCCC-UHFFFAOYSA-N
XLogP0.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-butoxypropyl)-2-(cyclopentylamino)acetamide
CID 113219331
N-butyl-2-[(3,3-dimethylcyclopentyl)amino]acetamide
CID 114545867
N-butyl-2-[(2-hydroxycyclohexyl)amino]acetamide
CID 62359661
2-[(4-propan-2-ylcyclohexyl)amino]-N-propylacetamide
CID 62703314
N-butyl-2-[(2,2-dimethyloxan-4-yl)amino]acetamide
CID 83033491
N-butyl-3-(cyclopentylamino)propanamide
CID 109012177
2-(cyclopropylamino)-N-(3-pyrrolidin-1-ylpropyl)acetamide
CID 60843562
2-(cyclopropylamino)-N-(2-ethylhexyl)acetamide
CID 54773137
2-(cyclopropylamino)-N-[3-(cyclopropylmethoxy)propyl]acetamide
CID 60712208
2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide
CID 54904868
2-(cyclopropylamino)-N-(3-pyrazol-1-ylpropyl)acetamide
CID 115761179
N-butyl-2-[[(1R)-1-cyclohexylethyl]amino]acetamide
CID 81384625

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(cyclopropylamino)acetamide?
The IUPAC name of N-butyl-2-(cyclopropylamino)acetamide (CID 54773122) is N-butyl-2-(cyclopropylamino)acetamide.
What is the SMILES notation for N-butyl-2-(cyclopropylamino)acetamide?
The canonical SMILES for N-butyl-2-(cyclopropylamino)acetamide is CCCCNC(=O)CNC1CC1.
What is the InChIKey of N-butyl-2-(cyclopropylamino)acetamide?
The InChIKey is GAFXBGIESFDCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-3-6-10-9(12)7-11-8-4-5-8/h8,11H,2-7H2,1H3,(H,10,12).
What are the key properties of N-butyl-2-(cyclopropylamino)acetamide?
N-butyl-2-(cyclopropylamino)acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.65, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(cyclopropylamino)acetamide is sourced from PubChem (CID 54773122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).