N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane

C15H29NO — CID 90040795

IUPACN-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane
SMILESCC(=O)NC1CC1.CC1CCC(C(C)C)CC1
InChIInChI=1S/C10H20.C5H9NO/c1-8(2)10-6-4-9(3)5-7-10;1-4(7)6-5-2-3-5/h8-10H,4-7H2,1-3H3;5H,2-3H2,1H3,(H,6,7)
InChIKeyWXYTXDJVLWQREJ-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.75
Rot. Bonds2

About N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane

N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane (PubChem CID 90040795) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane.

Molecular Properties

Compound NameN-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane
PubChem CID90040795
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane
SMILESCC(=O)NC1CC1.CC1CCC(C(C)C)CC1
InChIInChI=1S/C10H20.C5H9NO/c1-8(2)10-6-4-9(3)5-7-10;1-4(7)6-5-2-3-5/h8-10H,4-7H2,1-3H3;5H,2-3H2,1H3,(H,6,7)
InChIKeyWXYTXDJVLWQREJ-UHFFFAOYSA-N
XLogP3.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-propan-2-ylcyclobutyl)acetamide
CID 59410589
2-methylbut-1-ene;N-(4-methylcyclohexyl)acetamide
CID 143490442
N-(3,6-dimethylcycloheptyl)acetamide
CID 89468976
(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide
CID 70253137
2,2-dimethylpropane;N-[4-(2-methylpropyl)cyclohexyl]acetamide
CID 143679786
carbamic acid;1-methyl-4-propan-2-ylcyclohexane
CID 67059714
methane;1-methyl-4-propan-2-ylcyclohexane
CID 178082994
1,1-dimethyl-3-(4-propan-2-ylcyclohexyl)urea
CID 127484817
cis-(1S,4R)-1-methyl-4-propan-2-ylcycloheptane
CID 58254317
2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide
CID 104963390
2-amino-N-(4-propan-2-ylcyclohexyl)pentanamide
CID 119339852
(3S)-3-hydroxy-N-(4-methylcyclohexyl)butanamide
CID 89423792

Frequently Asked Questions

What is the IUPAC name of N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane?
The IUPAC name of N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane (CID 90040795) is N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane.
What is the SMILES notation for N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane?
The canonical SMILES for N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane is CC(=O)NC1CC1.CC1CCC(C(C)C)CC1.
What is the InChIKey of N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane?
The InChIKey is WXYTXDJVLWQREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.C5H9NO/c1-8(2)10-6-4-9(3)5-7-10;1-4(7)6-5-2-3-5/h8-10H,4-7H2,1-3H3;5H,2-3H2,1H3,(H,6,7).
What are the key properties of N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane?
N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane has a molecular weight of 239.40 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane is sourced from PubChem (CID 90040795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).