N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide

C14H28N2O — CID 79122316

IUPACN,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide
SMILESCNC1CCC(N(C)C(=O)CC(C)(C)C)CC1
InChIInChI=1S/C14H28N2O/c1-14(2,3)10-13(17)16(5)12-8-6-11(15-4)7-9-12/h11-12,15H,6-10H2,1-5H3
InChIKeyAEXWTPANOLWOCQ-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.41
Rot. Bonds3

About N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide

N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide (PubChem CID 79122316) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide.

Molecular Properties

Compound NameN,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide
PubChem CID79122316
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide
SMILESCNC1CCC(N(C)C(=O)CC(C)(C)C)CC1
InChIInChI=1S/C14H28N2O/c1-14(2,3)10-13(17)16(5)12-8-6-11(15-4)7-9-12/h11-12,15H,6-10H2,1-5H3
InChIKeyAEXWTPANOLWOCQ-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,4,4-trifluoro-N-methyl-N-[4-(methylamino)cyclohexyl]butanamide
CID 79120537
1-methyl-1-[4-(methylamino)cyclohexyl]urea
CID 79123173
tert-butyl N-methyl-N-[4-(methylamino)cyclohexyl]carbamate;hydrochloride
CID 18397394
N-(1,1-dioxothiolan-3-yl)-N,3,3-trimethylbutanamide
CID 110755793
3-methoxy-N,3-dimethyl-N-[4-(propylamino)cyclohexyl]butanamide
CID 103017156
N,N-dimethyl-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide
CID 79122060
4-N-(3,3-dimethylbutyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122136
2-(cyclohexen-1-yl)-N-methyl-N-[4-(methylamino)cyclohexyl]acetamide
CID 79110452
N-tert-butyl-2-[methyl-[4-(methylamino)cyclohexyl]amino]propanamide
CID 79122141
N-cyclopropyl-N-methyl-2-(2-methylbutan-2-ylamino)acetamide
CID 61488557
2-(4-chlorophenoxy)-N-methyl-N-[4-(methylamino)cyclohexyl]acetamide
CID 79117952
N-[4-(ethylamino)cyclohexyl]-N,3,4,4-tetramethylpentanamide
CID 79122094

Frequently Asked Questions

What is the IUPAC name of N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide?
The IUPAC name of N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide (CID 79122316) is N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide.
What is the SMILES notation for N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide?
The canonical SMILES for N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide is CNC1CCC(N(C)C(=O)CC(C)(C)C)CC1.
What is the InChIKey of N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide?
The InChIKey is AEXWTPANOLWOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2,3)10-13(17)16(5)12-8-6-11(15-4)7-9-12/h11-12,15H,6-10H2,1-5H3.
What are the key properties of N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide?
N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide has a molecular weight of 240.39 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,3-trimethyl-N-[4-(methylamino)cyclohexyl]butanamide is sourced from PubChem (CID 79122316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).