4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide

C11H23N3O — CID 66430431

IUPAC4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide
SMILESCN(C)C(=O)CC(CN)N(C)CC1CC1
InChIInChI=1S/C11H23N3O/c1-13(2)11(15)6-10(7-12)14(3)8-9-4-5-9/h9-10H,4-8,12H2,1-3H3
InChIKeyXSUKPKQCZLGRKY-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.13
Rot. Bonds6

About 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide

4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide (PubChem CID 66430431) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide.

Molecular Properties

Compound Name4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide
PubChem CID66430431
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide
SMILESCN(C)C(=O)CC(CN)N(C)CC1CC1
InChIInChI=1S/C11H23N3O/c1-13(2)11(15)6-10(7-12)14(3)8-9-4-5-9/h9-10H,4-8,12H2,1-3H3
InChIKeyXSUKPKQCZLGRKY-UHFFFAOYSA-N
XLogP0.13
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-[cyclohexylmethyl(methyl)amino]-N,N-dimethylbutanamide
CID 66429827
4-amino-3-[cyclohexylmethyl(methyl)amino]butanamide
CID 66427542
4-amino-3-[cyclopropylmethyl(methyl)amino]-N-propylbutanamide
CID 66427616
4-amino-3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-N,N-dimethylbutanamide
CID 79314706
4-amino-3-[2,2-dimethylpropyl(methyl)amino]-N,N-dimethylbutanamide
CID 66432485
4-amino-3-[3-(dimethylamino)propyl-methylamino]-N,N-dimethylbutanamide
CID 66430036
3-[cyclopropylmethyl(methyl)amino]pentanoic acid
CID 63067785
4-amino-3-[2-ethoxyethyl(methyl)amino]-N,N-dimethylbutanamide
CID 81059610
2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine
CID 63632440
4-amino-3-[cyclopropyl(3-methylbutyl)amino]-N,N-dimethylbutanamide
CID 79036633
4-amino-3-[3-methoxypropyl(methyl)amino]-N,N-dimethylbutanamide
CID 66431256
2-N-(cyclohexylmethyl)-2-N-methylbutane-1,2-diamine
CID 61444608

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide?
The IUPAC name of 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide (CID 66430431) is 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide.
What is the SMILES notation for 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide?
The canonical SMILES for 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide is CN(C)C(=O)CC(CN)N(C)CC1CC1.
What is the InChIKey of 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide?
The InChIKey is XSUKPKQCZLGRKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-13(2)11(15)6-10(7-12)14(3)8-9-4-5-9/h9-10H,4-8,12H2,1-3H3.
What are the key properties of 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide?
4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide has a molecular weight of 213.32 g/mol, XLogP of 0.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-[cyclopropylmethyl(methyl)amino]-N,N-dimethylbutanamide is sourced from PubChem (CID 66430431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).