2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide

C10H19N3O2 — CID 62861520

IUPAC2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide
SMILESCN(CC1CCC1)C(=O)C(N)CC(N)=O
InChIInChI=1S/C10H19N3O2/c1-13(6-7-3-2-4-7)10(15)8(11)5-9(12)14/h7-8H,2-6,11H2,1H3,(H2,12,14)
InChIKeyJANBOTIRAWXGRL-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.55
Rot. Bonds5

About 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide

2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide (PubChem CID 62861520) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide.

Molecular Properties

Compound Name2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide
PubChem CID62861520
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide
SMILESCN(CC1CCC1)C(=O)C(N)CC(N)=O
InChIInChI=1S/C10H19N3O2/c1-13(6-7-3-2-4-7)10(15)8(11)5-9(12)14/h7-8H,2-6,11H2,1H3,(H2,12,14)
InChIKeyJANBOTIRAWXGRL-UHFFFAOYSA-N
XLogP-0.55
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(cyclobutylmethyl)-N-methylpentanamide
CID 103796269
2-amino-N-(cyclopentylmethyl)-N,4-dimethylpentanamide
CID 63654905
(2S)-2-amino-N-(cyclohexylmethyl)-N-methylpentanamide
CID 107568999
(2S)-2-amino-N-(cyclopentylmethyl)-N,4-dimethylpentanamide;hydrochloride
CID 119759252
1-(cyclobutylmethyl)-1-methylurea
CID 62860439
2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylbutanediamide
CID 60962649
2-[(2,4-diamino-4-oxobutanoyl)-methylamino]acetic acid
CID 61157104
2-amino-N-(cyclopentylmethyl)-4-methoxy-N-methylbutanamide
CID 63654910
2-amino-N-(cyclobutylmethyl)-N,3-dimethylpentanamide
CID 62862218
2-(aminomethyl)-N-(cyclobutylmethyl)-N,4,4-trimethylpentanamide
CID 107472079
(2R)-4-amino-2-[[cyclobutylmethyl(methyl)carbamoyl]amino]-4-oxobutanoic acid
CID 107827597
2-amino-N-(cyclohexylmethyl)-N,3-dimethylbutanamide;hydrochloride
CID 119279206

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide?
The IUPAC name of 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide (CID 62861520) is 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide.
What is the SMILES notation for 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide?
The canonical SMILES for 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide is CN(CC1CCC1)C(=O)C(N)CC(N)=O.
What is the InChIKey of 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide?
The InChIKey is JANBOTIRAWXGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-13(6-7-3-2-4-7)10(15)8(11)5-9(12)14/h7-8H,2-6,11H2,1H3,(H2,12,14).
What are the key properties of 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide?
2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide has a molecular weight of 213.28 g/mol, XLogP of -0.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide is sourced from PubChem (CID 62861520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).