4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide

C10H19N3O2 — CID 60865576

IUPAC4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
SMILESCC(N)(C(=O)NCCCC(N)=O)C1CC1
InChIInChI=1S/C10H19N3O2/c1-10(12,7-4-5-7)9(15)13-6-2-3-8(11)14/h7H,2-6,12H2,1H3,(H2,11,14)(H,13,15)
InChIKeyQZKODSHANMHABX-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.50
Rot. Bonds6

About 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide

4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide (PubChem CID 60865576) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide.

Molecular Properties

Compound Name4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
PubChem CID60865576
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
SMILESCC(N)(C(=O)NCCCC(N)=O)C1CC1
InChIInChI=1S/C10H19N3O2/c1-10(12,7-4-5-7)9(15)13-6-2-3-8(11)14/h7H,2-6,12H2,1H3,(H2,11,14)(H,13,15)
InChIKeyQZKODSHANMHABX-UHFFFAOYSA-N
XLogP-0.50
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.50
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

2-amino-N-(2-cyclopentylethyl)-2-cyclopropylpropanamide
CID 60919572
2-amino-2-cyclopropyl-N-[3-(dimethylamino)-3-oxopropyl]propanamide
CID 60926837
2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide
CID 115746770
2-amino-2-cyclopropyl-N-(cyclopropylmethyl)propanamide
CID 60867867
2-amino-2-cyclopropyl-N-[2-(2-methylpropoxy)ethyl]propanamide
CID 115746731
2-amino-2-cyclopropyl-N-(2-ethylbutyl)propanamide
CID 115746720
2-amino-2-cyclopropyl-N-[2-(cyclopropylamino)-2-oxoethyl]propanamide
CID 60866101
2-amino-2-cyclopropyl-N-[(1-hydroxycycloheptyl)methyl]propanamide
CID 65122341
2-amino-2-cyclopropyl-N-(2,2-dimethoxyethyl)propanamide
CID 61274918
3-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
CID 115746838
2-amino-2-cyclopropyl-N-(2-methylbutyl)propanamide
CID 62694160
2-amino-2-cyclopropyl-N-(2-pyrazol-1-ylethyl)propanamide
CID 61461071

Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide?
The IUPAC name of 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide (CID 60865576) is 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide.
What is the SMILES notation for 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide?
The canonical SMILES for 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide is CC(N)(C(=O)NCCCC(N)=O)C1CC1.
What is the InChIKey of 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide?
The InChIKey is QZKODSHANMHABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-10(12,7-4-5-7)9(15)13-6-2-3-8(11)14/h7H,2-6,12H2,1H3,(H2,11,14)(H,13,15).
What are the key properties of 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide?
4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide has a molecular weight of 213.28 g/mol, XLogP of -0.50, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide is sourced from PubChem (CID 60865576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).