1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide

C11H21NO — CID 20614532

IUPAC1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide
SMILESCC(C)NC(=O)C1(C)CC(C)(C)C1
InChIInChI=1S/C11H21NO/c1-8(2)12-9(13)11(5)6-10(3,4)7-11/h8H,6-7H2,1-5H3,(H,12,13)
InChIKeyLDIPTGPPIPNYOJ-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.34
Rot. Bonds2

About 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide

1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide (PubChem CID 20614532) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide
PubChem CID20614532
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide
SMILESCC(C)NC(=O)C1(C)CC(C)(C)C1
InChIInChI=1S/C11H21NO/c1-8(2)12-9(13)11(5)6-10(3,4)7-11/h8H,6-7H2,1-5H3,(H,12,13)
InChIKeyLDIPTGPPIPNYOJ-UHFFFAOYSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(aminomethyl)-N-ethylcyclobutane-1-carboxamide
CID 80587173
(7R)-7-methyl-6-azaspiro[3.4]octan-5-one
CID 155819762
(7S)-7-methyl-6-azaspiro[3.4]octan-5-one
CID 155819796
N-cyclohexyl-3,3-dimethylbutanamide
CID 343763
N-(2-methylpropyl)cyclobutanecarboxamide
CID 60636791
1-N,1-N'-di(propan-2-yl)cyclobutane-1,1-dicarboxamide
CID 84587642
Butanamide, N-cyclohexyl-2,2-dimethyl-
CID 4473847
N-isopentyl-4-methylpentanamide
CID 20442825
2-ethyl-N-propan-2-ylpentanamide
CID 91156539
(1S)-2,2-dimethyl-N-(2,2,3,3-tetramethylcyclopropyl)cyclopropane-1-carboxamide
CID 164640590
N-Ethyl-2,2,4-trimethylvaleramide
CID 101047
N-Isopropyl-2,3-dimethyl-2-(1-methylpropyl)valeramide
CID 3016608

Frequently Asked Questions

What is the IUPAC name of 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide?
The IUPAC name of 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide (CID 20614532) is 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide.
What is the SMILES notation for 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide?
The canonical SMILES for 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide is CC(C)NC(=O)C1(C)CC(C)(C)C1.
What is the InChIKey of 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide?
The InChIKey is LDIPTGPPIPNYOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8(2)12-9(13)11(5)6-10(3,4)7-11/h8H,6-7H2,1-5H3,(H,12,13).
What are the key properties of 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide?
1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide has a molecular weight of 183.29 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide is sourced from PubChem (CID 20614532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).