N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide

C9H18N2O — CID 82503227

IUPACN-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide
SMILESCC(CN)N(C)C(=O)C1CCC1
InChIInChI=1S/C9H18N2O/c1-7(6-10)11(2)9(12)8-4-3-5-8/h7-8H,3-6,10H2,1-2H3
InChIKeyIJDNVFWENLAFQG-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.59
Rot. Bonds3

About N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide

N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide (PubChem CID 82503227) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide
PubChem CID82503227
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide
SMILESCC(CN)N(C)C(=O)C1CCC1
InChIInChI=1S/C9H18N2O/c1-7(6-10)11(2)9(12)8-4-3-5-8/h7-8H,3-6,10H2,1-2H3
InChIKeyIJDNVFWENLAFQG-UHFFFAOYSA-N
XLogP0.59
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-chloropropan-2-yl)-N-methylcyclobutanecarboxamide
CID 104555934
N-(1-aminopropan-2-yl)-N-methyl-3-(trifluoromethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119583364
N-butan-2-yl-N-methylcyclohexanecarboxamide
CID 153425265
N-(1-hydroxypropan-2-yl)-N-methylcyclooctanecarboxamide
CID 115869363
N-(1-chloropropan-2-yl)-N-methylcyclooctanecarboxamide
CID 104555564
N-(1-hydroxypropan-2-yl)-N-methylcyclopropanecarboxamide
CID 115765115
ethyl (2R)-2-[cyclohexanecarbonyl(methyl)amino]propanoate
CID 69164951
1-(1-aminopropan-2-yl)-3-cyclobutyl-1-methylurea
CID 82504241
N-(4-amino-4-hydroxyiminobutan-2-yl)-N-methylcyclopentanecarboxamide
CID 76987598
N-(1-aminopropan-2-yl)-N-methylazepane-1-carboxamide
CID 79152627
N-(1-methoxypropan-2-yl)-N-methylcyclopropanecarboxamide
CID 60794013
N-(1-aminopropan-2-yl)-2-cycloheptyl-N-methylacetamide
CID 115737376

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide?
The IUPAC name of N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide (CID 82503227) is N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide is CC(CN)N(C)C(=O)C1CCC1.
What is the InChIKey of N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide?
The InChIKey is IJDNVFWENLAFQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(6-10)11(2)9(12)8-4-3-5-8/h7-8H,3-6,10H2,1-2H3.
What are the key properties of N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide?
N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-N-methylcyclobutanecarboxamide is sourced from PubChem (CID 82503227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).