2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide

C12H24N2O — CID 60944592

IUPAC2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide
SMILESCCCCN(C(=O)C(N)C(C)C)C1CC1
InChIInChI=1S/C12H24N2O/c1-4-5-8-14(10-6-7-10)12(15)11(13)9(2)3/h9-11H,4-8,13H2,1-3H3
InChIKeyWTZPEIASLBURQM-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.76
Rot. Bonds6

About 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide

2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide (PubChem CID 60944592) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide
PubChem CID60944592
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide
SMILESCCCCN(C(=O)C(N)C(C)C)C1CC1
InChIInChI=1S/C12H24N2O/c1-4-5-8-14(10-6-7-10)12(15)11(13)9(2)3/h9-11H,4-8,13H2,1-3H3
InChIKeyWTZPEIASLBURQM-UHFFFAOYSA-N
XLogP1.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-cyclopropyl-3-methyl-N-propylbutanamide
CID 79011597
2-amino-N-butyl-N-(1,1-dioxothiolan-3-yl)-3-methylbutanamide
CID 54869645
(2R)-2-amino-N-butyl-N-cyclopropyl-4-methylpentanamide
CID 104903070
2-amino-N-cyclobutyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 102861908
2-amino-N-butyl-N-cyclopropyl-3-methoxypropanamide
CID 81082508
(2S)-2-amino-N,N-dibutyl-3-methylbutanamide
CID 28983163
2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 60952653
(2S)-2-amino-N-cyclopropyl-N-propylhexanamide
CID 103950188
2-amino-N-cyclohexyl-N-ethyl-3-methylbutanamide;hydrochloride
CID 56831854
(2R)-2-amino-N-butan-2-yl-N-butyl-3-methylbutanamide
CID 79012967
(2S)-2-amino-N-cyclopropyl-N-(2-hydroxyethyl)hexanamide
CID 103951026
(2S)-2-amino-N-butyl-N-cyclopropyl-3-(4-hydroxyphenyl)propanamide
CID 61165075

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide?
The IUPAC name of 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide (CID 60944592) is 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide.
What is the SMILES notation for 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide?
The canonical SMILES for 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide is CCCCN(C(=O)C(N)C(C)C)C1CC1.
What is the InChIKey of 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide?
The InChIKey is WTZPEIASLBURQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-5-8-14(10-6-7-10)12(15)11(13)9(2)3/h9-11H,4-8,13H2,1-3H3.
What are the key properties of 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide?
2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide has a molecular weight of 212.34 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide is sourced from PubChem (CID 60944592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).