N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide

C14H24N2O — CID 112745173

IUPACN-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide
SMILESCN(CC1CC(N)C1)C(=O)C(C1CC1)C1CC1
InChIInChI=1S/C14H24N2O/c1-16(8-9-6-12(15)7-9)14(17)13(10-2-3-10)11-4-5-11/h9-13H,2-8,15H2,1H3
InChIKeyBYDRKGLYUCUNLV-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.62
Rot. Bonds5

About N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide

N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide (PubChem CID 112745173) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide.

Molecular Properties

Compound NameN-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide
PubChem CID112745173
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide
SMILESCN(CC1CC(N)C1)C(=O)C(C1CC1)C1CC1
InChIInChI=1S/C14H24N2O/c1-16(8-9-6-12(15)7-9)14(17)13(10-2-3-10)11-4-5-11/h9-13H,2-8,15H2,1H3
InChIKeyBYDRKGLYUCUNLV-UHFFFAOYSA-N
XLogP1.62
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dicyclopropyl-N-methyl-N-(piperidin-4-ylmethyl)acetamide
CID 112745071
2-(3-aminocyclohexyl)-N-(cyclopentylmethyl)-N-methylpropanamide
CID 106592908
(2R)-2-amino-N-(cyclopropylmethyl)-N,3-dimethylbutanamide
CID 79013234
3-[(2,2-dicyclopropylacetyl)-methylamino]-2-methylpropanoic acid
CID 120524386
4-[cyclopentylmethyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498428
2-bromo-N-(cyclopropylmethyl)-N-methylpropanamide
CID 107904481
2-(3-aminocyclohexyl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide
CID 106592894
2-(3-aminocyclohexyl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
CID 106592896
2-(aminomethyl)-N-(cyclopropylmethyl)-N,4,4-trimethylpentanamide
CID 107471602
2-amino-N-(cyclopentylmethyl)-N,4-dimethylpentanamide
CID 63654905
2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide
CID 62860792
2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide
CID 62861520

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide?
The IUPAC name of N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide (CID 112745173) is N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide.
What is the SMILES notation for N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide?
The canonical SMILES for N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide is CN(CC1CC(N)C1)C(=O)C(C1CC1)C1CC1.
What is the InChIKey of N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide?
The InChIKey is BYDRKGLYUCUNLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-16(8-9-6-12(15)7-9)14(17)13(10-2-3-10)11-4-5-11/h9-13H,2-8,15H2,1H3.
What are the key properties of N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide?
N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide has a molecular weight of 236.36 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclobutyl)methyl]-2,2-dicyclopropyl-N-methylacetamide is sourced from PubChem (CID 112745173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).