3-amino-N-(3-cyclopropylpropyl)butanamide

C10H20N2O — CID 115740565

IUPAC3-amino-N-(3-cyclopropylpropyl)butanamide
SMILESCC(N)CC(=O)NCCCC1CC1
InChIInChI=1S/C10H20N2O/c1-8(11)7-10(13)12-6-2-3-9-4-5-9/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyWCSCMPBYNATAMX-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.03
Rot. Bonds6

About 3-amino-N-(3-cyclopropylpropyl)butanamide

3-amino-N-(3-cyclopropylpropyl)butanamide (PubChem CID 115740565) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-amino-N-(3-cyclopropylpropyl)butanamide.

Molecular Properties

Compound Name3-amino-N-(3-cyclopropylpropyl)butanamide
PubChem CID115740565
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-amino-N-(3-cyclopropylpropyl)butanamide
SMILESCC(N)CC(=O)NCCCC1CC1
InChIInChI=1S/C10H20N2O/c1-8(11)7-10(13)12-6-2-3-9-4-5-9/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyWCSCMPBYNATAMX-UHFFFAOYSA-N
XLogP1.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.03
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

3-amino-N-(2-cyclohexylethyl)butanamide;hydrochloride
CID 119725742
(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide
CID 104904077
(2R)-2-amino-N-(3-cyclopropylpropyl)-3,3-dimethylbutanamide
CID 104876667
4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride
CID 120560365
(2S)-2-amino-N-(3-cyclopentylpropyl)propanamide
CID 103795255
3-amino-N-[2-(cyclopropylmethylsulfonyl)ethyl]butanamide;hydrochloride
CID 119822651
(3S)-3-(aminomethyl)-N-(3-cyclopentylpropyl)-5-methylhexanamide
CID 106011625
N-(3-cyclopropylpropyl)-2-(methylamino)acetamide
CID 115740545
(2R)-2-amino-N-(3-cyclopentylpropyl)-3,3-dimethylbutanamide
CID 114137096
(2S)-2-amino-N-(3-cyclopentylpropyl)butanamide
CID 103795274
(2S)-2-amino-N-(3-cyclopentylpropyl)-4-methylpentanamide;hydrochloride
CID 119724237
3-amino-N-[2-(2-methylcyclohexyl)ethyl]butanamide;hydrochloride
CID 119783145

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-cyclopropylpropyl)butanamide?
The IUPAC name of 3-amino-N-(3-cyclopropylpropyl)butanamide (CID 115740565) is 3-amino-N-(3-cyclopropylpropyl)butanamide.
What is the SMILES notation for 3-amino-N-(3-cyclopropylpropyl)butanamide?
The canonical SMILES for 3-amino-N-(3-cyclopropylpropyl)butanamide is CC(N)CC(=O)NCCCC1CC1.
What is the InChIKey of 3-amino-N-(3-cyclopropylpropyl)butanamide?
The InChIKey is WCSCMPBYNATAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(11)7-10(13)12-6-2-3-9-4-5-9/h8-9H,2-7,11H2,1H3,(H,12,13).
What are the key properties of 3-amino-N-(3-cyclopropylpropyl)butanamide?
3-amino-N-(3-cyclopropylpropyl)butanamide has a molecular weight of 184.28 g/mol, XLogP of 1.03, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-cyclopropylpropyl)butanamide is sourced from PubChem (CID 115740565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).