3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide

C12H24N2O — CID 119326669

IUPAC3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide
SMILESCC(C)CC1(CNC(=O)CCN)CCC1
InChIInChI=1S/C12H24N2O/c1-10(2)8-12(5-3-6-12)9-14-11(15)4-7-13/h10H,3-9,13H2,1-2H3,(H,14,15)
InChIKeyIFYPVBVEZBNXOQ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.67
Rot. Bonds6

About 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide

3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide (PubChem CID 119326669) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide
PubChem CID119326669
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide
SMILESCC(C)CC1(CNC(=O)CCN)CCC1
InChIInChI=1S/C12H24N2O/c1-10(2)8-12(5-3-6-12)9-14-11(15)4-7-13/h10H,3-9,13H2,1-2H3,(H,14,15)
InChIKeyIFYPVBVEZBNXOQ-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylamino)-N-[[1-(2-methylpropyl)cyclobutyl]methyl]acetamide
CID 119788858
3-(2-aminophenyl)-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide
CID 120610868
2-[1-[(3-aminopropanoylamino)methyl]cyclobutyl]acetic acid
CID 81161274
1-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]cyclopropane-1-carboxamide
CID 119788836
[1-[[[1-(2-methylpropyl)cyclopentyl]methylamino]methyl]cyclobutyl]methanamine
CID 113311851
(4S)-4-(4-methylpiperazin-1-yl)-N-[[1-(2-methylpropyl)cyclobutyl]methyl]pentanamide
CID 164637520
3-amino-N-[(1-ethylcyclopropyl)methyl]propanamide
CID 103796646
5-amino-2-methyl-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pentanamide
CID 104685343
1-amino-N-[[1-(2-methylpropyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
CID 119345128
4-amino-N-[(1-ethylcyclobutyl)methyl]pentanamide
CID 106813317
methyl 2-[[1-(2-methylpropyl)cyclopentyl]methylamino]-2-oxoacetate
CID 112617453
1-(N'-hydroxycarbamimidoyl)-N-[[1-(2-methylpropyl)cyclopentyl]methyl]cyclobutane-1-carboxamide
CID 80599385

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide?
The IUPAC name of 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide (CID 119326669) is 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide.
What is the SMILES notation for 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide?
The canonical SMILES for 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide is CC(C)CC1(CNC(=O)CCN)CCC1.
What is the InChIKey of 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide?
The InChIKey is IFYPVBVEZBNXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)8-12(5-3-6-12)9-14-11(15)4-7-13/h10H,3-9,13H2,1-2H3,(H,14,15).
What are the key properties of 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide?
3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide has a molecular weight of 212.34 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[[1-(2-methylpropyl)cyclobutyl]methyl]propanamide is sourced from PubChem (CID 119326669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).