N-(2-aminobutyl)-2-cyclopropylacetamide

C9H18N2O — CID 63733245

IUPACN-(2-aminobutyl)-2-cyclopropylacetamide
SMILESCCC(N)CNC(=O)CC1CC1
InChIInChI=1S/C9H18N2O/c1-2-8(10)6-11-9(12)5-7-3-4-7/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeyMUJQFZRWWXISHA-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.64
Rot. Bonds5

About N-(2-aminobutyl)-2-cyclopropylacetamide

N-(2-aminobutyl)-2-cyclopropylacetamide (PubChem CID 63733245) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-(2-aminobutyl)-2-cyclopropylacetamide.

Molecular Properties

Compound NameN-(2-aminobutyl)-2-cyclopropylacetamide
PubChem CID63733245
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-(2-aminobutyl)-2-cyclopropylacetamide
SMILESCCC(N)CNC(=O)CC1CC1
InChIInChI=1S/C9H18N2O/c1-2-8(10)6-11-9(12)5-7-3-4-7/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeyMUJQFZRWWXISHA-UHFFFAOYSA-N
XLogP0.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-2-methylpropyl)-2-cyclopropylacetamide
CID 62667808
N-(2-amino-4-methylpentyl)-2-cyclohexylacetamide
CID 107158692
2-(4-aminocyclohexyl)-N-(2,3-dimethylbutyl)acetamide
CID 64583220
N-(2-chlorobutyl)-2-cycloheptylacetamide
CID 114459139
N-(2-aminobutyl)-4-methylpentanamide
CID 63730752
N-(2-amino-3-hydroxybutyl)-2-cyclohexylacetamide
CID 64542106
2-cyclopentyl-N-(2-hydroxypropyl)acetamide
CID 60654176
2-[[(2-piperidin-4-ylacetyl)amino]methyl]butanoic acid
CID 65224540
N-(4-bromo-2-ethylbutyl)-2-cyclopentylacetamide
CID 114317695
2-cyclopropyl-N-[2-(ethylamino)ethyl]acetamide
CID 62659717
N-(2-chloro-3-methoxypropyl)-2-cyclopropylacetamide
CID 114298835
2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide
CID 103884693

Frequently Asked Questions

What is the IUPAC name of N-(2-aminobutyl)-2-cyclopropylacetamide?
The IUPAC name of N-(2-aminobutyl)-2-cyclopropylacetamide (CID 63733245) is N-(2-aminobutyl)-2-cyclopropylacetamide.
What is the SMILES notation for N-(2-aminobutyl)-2-cyclopropylacetamide?
The canonical SMILES for N-(2-aminobutyl)-2-cyclopropylacetamide is CCC(N)CNC(=O)CC1CC1.
What is the InChIKey of N-(2-aminobutyl)-2-cyclopropylacetamide?
The InChIKey is MUJQFZRWWXISHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-8(10)6-11-9(12)5-7-3-4-7/h7-8H,2-6,10H2,1H3,(H,11,12).
What are the key properties of N-(2-aminobutyl)-2-cyclopropylacetamide?
N-(2-aminobutyl)-2-cyclopropylacetamide has a molecular weight of 170.26 g/mol, XLogP of 0.64, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminobutyl)-2-cyclopropylacetamide is sourced from PubChem (CID 63733245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).