N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide

C17H30N2O2 — CID 84586419

IUPACN-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide
SMILESCC1CC(C(=O)NCC(C)(C)CNC(=O)C2CC(C)C2)C1
InChIInChI=1S/C17H30N2O2/c1-11-5-13(6-11)15(20)18-9-17(3,4)10-19-16(21)14-7-12(2)8-14/h11-14H,5-10H2,1-4H3,(H,18,20)(H,19,21)
InChIKeyZWWKUENGMRDWHG-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.34
Rot. Bonds6

About N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide

N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide (PubChem CID 84586419) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide
PubChem CID84586419
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC NameN-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide
SMILESCC1CC(C(=O)NCC(C)(C)CNC(=O)C2CC(C)C2)C1
InChIInChI=1S/C17H30N2O2/c1-11-5-13(6-11)15(20)18-9-17(3,4)10-19-16(21)14-7-12(2)8-14/h11-14H,5-10H2,1-4H3,(H,18,20)(H,19,21)
InChIKeyZWWKUENGMRDWHG-UHFFFAOYSA-N
XLogP2.34
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-methylpropyl)-3-methylcyclobutane-1-carboxamide
CID 130652190
2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propanoic acid
CID 115910003
N-(2-hydroxy-2,3-dimethylbutyl)-3,5-dimethylcyclohexane-1-carboxamide
CID 110021339
N-(2-hydroxyethyl)-3-methylcyclobutane-1-carboxamide
CID 131134003
cis-(1R,2S)-2-(2,2-dimethylbutylcarbamoyl)-4-methylcyclopentane-1-carboxylic acid
CID 114093176
N-(4-methoxy-2,2-dimethylbutyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 114126470
N-[2,2-dimethyl-3-(oxolane-3-carbonylamino)propyl]oxolane-3-carboxamide
CID 127304188
N-(5-bromo-2,2-dimethylpentyl)-4-methylcyclohexane-1-carboxamide
CID 114149740
(1R)-N-[3-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-2,2-dimethylpropyl]cyclohex-3-ene-1-carboxamide
CID 95621362
N-(3-amino-2,2-dimethylpropyl)cyclohexanecarboxamide
CID 115365726
N-(2-fluoro-2-methylbutyl)cyclopropanecarboxamide
CID 123444332
3-methyl-N'-propanoylcyclobutane-1-carbohydrazide
CID 131131894

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide?
The IUPAC name of N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide (CID 84586419) is N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide.
What is the SMILES notation for N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide?
The canonical SMILES for N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide is CC1CC(C(=O)NCC(C)(C)CNC(=O)C2CC(C)C2)C1.
What is the InChIKey of N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide?
The InChIKey is ZWWKUENGMRDWHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-11-5-13(6-11)15(20)18-9-17(3,4)10-19-16(21)14-7-12(2)8-14/h11-14H,5-10H2,1-4H3,(H,18,20)(H,19,21).
What are the key properties of N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide?
N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-[(3-methylcyclobutanecarbonyl)amino]propyl]-3-methylcyclobutane-1-carboxamide is sourced from PubChem (CID 84586419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).