N-butan-2-yl-4-cyclohexyl-N-methylbutanamide

C15H29NO — CID 112817760

IUPACN-butan-2-yl-4-cyclohexyl-N-methylbutanamide
SMILESCCC(C)N(C)C(=O)CCCC1CCCCC1
InChIInChI=1S/C15H29NO/c1-4-13(2)16(3)15(17)12-8-11-14-9-6-5-7-10-14/h13-14H,4-12H2,1-3H3
InChIKeyQQARYRNVKXTWKK-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.99
Rot. Bonds6

About N-butan-2-yl-4-cyclohexyl-N-methylbutanamide

N-butan-2-yl-4-cyclohexyl-N-methylbutanamide (PubChem CID 112817760) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-butan-2-yl-4-cyclohexyl-N-methylbutanamide.

Molecular Properties

Compound NameN-butan-2-yl-4-cyclohexyl-N-methylbutanamide
PubChem CID112817760
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-butan-2-yl-4-cyclohexyl-N-methylbutanamide
SMILESCCC(C)N(C)C(=O)CCCC1CCCCC1
InChIInChI=1S/C15H29NO/c1-4-13(2)16(3)15(17)12-8-11-14-9-6-5-7-10-14/h13-14H,4-12H2,1-3H3
InChIKeyQQARYRNVKXTWKK-UHFFFAOYSA-N
XLogP3.99
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-bromopropan-2-yl)-3-cyclohexyl-N-methylpropanamide
CID 104556269
4-cyclohexyl-N-methylbutanehydrazide
CID 116845177
N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
CID 62210682
4-cyclopentyl-N-methylbutanehydrazide
CID 116845176
3-(3-aminocyclohexyl)-N-butan-2-yl-N-methylpropanamide
CID 80701676
dipotassium;2-[4-cyclopentylbutanoyl(methyl)amino]pentanedioate
CID 176759017
N-(4-amino-4-hydroxyiminobutan-2-yl)-3-cyclopentyl-N-methylpropanamide
CID 76987836
4-cyclohexyl-N-(5-hydroxypentyl)-N-methylbutanamide
CID 107202086
3-cyclohexyl-N,N-di(propan-2-yl)propanamide
CID 4560477
N-butan-2-yl-N-methylcyclohexanecarboxamide
CID 153425265
4-cyclohexyl-N-(2-hydroxy-3-methoxypropyl)-N-methylbutanamide
CID 54993673
4-cyclohexyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylbutanamide
CID 115759935

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-4-cyclohexyl-N-methylbutanamide?
The IUPAC name of N-butan-2-yl-4-cyclohexyl-N-methylbutanamide (CID 112817760) is N-butan-2-yl-4-cyclohexyl-N-methylbutanamide.
What is the SMILES notation for N-butan-2-yl-4-cyclohexyl-N-methylbutanamide?
The canonical SMILES for N-butan-2-yl-4-cyclohexyl-N-methylbutanamide is CCC(C)N(C)C(=O)CCCC1CCCCC1.
What is the InChIKey of N-butan-2-yl-4-cyclohexyl-N-methylbutanamide?
The InChIKey is QQARYRNVKXTWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-13(2)16(3)15(17)12-8-11-14-9-6-5-7-10-14/h13-14H,4-12H2,1-3H3.
What are the key properties of N-butan-2-yl-4-cyclohexyl-N-methylbutanamide?
N-butan-2-yl-4-cyclohexyl-N-methylbutanamide has a molecular weight of 239.40 g/mol, XLogP of 3.99, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-4-cyclohexyl-N-methylbutanamide is sourced from PubChem (CID 112817760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).