N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide

C14H26N2O2 — CID 115277521

IUPACN-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide
SMILESCN(C(=O)CC1CCOCC1)C1CCC(N)CC1
InChIInChI=1S/C14H26N2O2/c1-16(13-4-2-12(15)3-5-13)14(17)10-11-6-8-18-9-7-11/h11-13H,2-10,15H2,1H3
InChIKeyBIBJJIXDYHFKEJ-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.53
Rot. Bonds3

About N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide

N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide (PubChem CID 115277521) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide
PubChem CID115277521
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide
SMILESCN(C(=O)CC1CCOCC1)C1CCC(N)CC1
InChIInChI=1S/C14H26N2O2/c1-16(13-4-2-12(15)3-5-13)14(17)10-11-6-8-18-9-7-11/h11-13H,2-10,15H2,1H3
InChIKeyBIBJJIXDYHFKEJ-UHFFFAOYSA-N
XLogP1.53
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(hydroxymethyl)cyclohexyl]-N-methyl-2-(oxan-4-yl)acetamide
CID 115277339
2-(4-aminocyclohexyl)-N-methyl-N-(oxan-4-ylmethyl)acetamide
CID 55226080
2-(4-aminopiperidin-1-yl)-N-methyl-N-(oxan-4-yl)acetamide
CID 79328227
2-(4-aminocyclohexyl)-N,N-dimethylacetamide
CID 62781479
N-methyl-2-(oxolan-3-yl)-N-pyrrolidin-3-ylacetamide
CID 119551379
ethyl N-(4-aminocyclohexyl)-N-methylcarbamate
CID 79121309
N-(4-aminocyclohexyl)-3-cyclobutyl-N-methylpropanamide
CID 115277537
N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 75502533
2-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylacetamide
CID 116817264
N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide
CID 115272471
N-(4-aminocyclohexyl)-N-methyl-2-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;hydrochloride
CID 170897051
2-(2-aminocyclohexyl)-N-cyclopentyl-N-methylacetamide
CID 62782509

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide (CID 115277521) is N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide is CN(C(=O)CC1CCOCC1)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide?
The InChIKey is BIBJJIXDYHFKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-16(13-4-2-12(15)3-5-13)14(17)10-11-6-8-18-9-7-11/h11-13H,2-10,15H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide?
N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide has a molecular weight of 254.37 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 115277521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).