N-(cyclopropylmethyl)-2,2-dimethylbutanamide

C10H19NO — CID 89142508

IUPACN-(cyclopropylmethyl)-2,2-dimethylbutanamide
SMILESCCC(C)(C)C(=O)NCC1CC1
InChIInChI=1S/C10H19NO/c1-4-10(2,3)9(12)11-7-8-5-6-8/h8H,4-7H2,1-3H3,(H,11,12)
InChIKeyQCPXNRVMGBJXQM-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds4

About N-(cyclopropylmethyl)-2,2-dimethylbutanamide

N-(cyclopropylmethyl)-2,2-dimethylbutanamide (PubChem CID 89142508) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2,2-dimethylbutanamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2,2-dimethylbutanamide
PubChem CID89142508
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-(cyclopropylmethyl)-2,2-dimethylbutanamide
SMILESCCC(C)(C)C(=O)NCC1CC1
InChIInChI=1S/C10H19NO/c1-4-10(2,3)9(12)11-7-8-5-6-8/h8H,4-7H2,1-3H3,(H,11,12)
InChIKeyQCPXNRVMGBJXQM-UHFFFAOYSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-dimethyl-N-[(6-methylpiperidin-3-yl)methyl]butanamide
CID 63009400
2,2-dichloro-N-(cyclopropylmethyl)propanamide
CID 126988443
2-amino-N-[(4-ethylcyclohexyl)methyl]-2-methylbutanamide
CID 79805944
2-amino-N-[(4-hydroxycyclohexyl)methyl]-2-methylbutanamide
CID 106135461
2-amino-N-(cyclopentylmethyl)-2-methylbutanamide
CID 79796793
2-amino-2-cyclopropyl-N-(cyclopropylmethyl)propanamide
CID 60867867
3-chloro-2,2-dimethyl-N-(oxan-4-ylmethyl)propanamide
CID 63712064
N-[(4-hydroxycyclohexyl)methyl]-2-methyl-2-methylsulfonylpropanamide
CID 114146309
2-amino-N-[(4-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 106135736
2-amino-N-(cyclopentylmethyl)-2-methylpropanamide
CID 61266758
N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide
CID 106123782
2,2-dimethyl-3-[(4-methylcyclohexyl)methylamino]-3-oxopropanoic acid
CID 82820923

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2,2-dimethylbutanamide?
The IUPAC name of N-(cyclopropylmethyl)-2,2-dimethylbutanamide (CID 89142508) is N-(cyclopropylmethyl)-2,2-dimethylbutanamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2,2-dimethylbutanamide?
The canonical SMILES for N-(cyclopropylmethyl)-2,2-dimethylbutanamide is CCC(C)(C)C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2,2-dimethylbutanamide?
The InChIKey is QCPXNRVMGBJXQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-10(2,3)9(12)11-7-8-5-6-8/h8H,4-7H2,1-3H3,(H,11,12).
What are the key properties of N-(cyclopropylmethyl)-2,2-dimethylbutanamide?
N-(cyclopropylmethyl)-2,2-dimethylbutanamide has a molecular weight of 169.27 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2,2-dimethylbutanamide is sourced from PubChem (CID 89142508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).