4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide

C14H26N2O2 — CID 82754385

IUPAC4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide
SMILESCC1CC(N)CCC1C(=O)N(C)C1CCOC1C
InChIInChI=1S/C14H26N2O2/c1-9-8-11(15)4-5-12(9)14(17)16(3)13-6-7-18-10(13)2/h9-13H,4-8,15H2,1-3H3
InChIKeyQRXQSZAFVOPSEJ-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.39
Rot. Bonds2

About 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide

4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide (PubChem CID 82754385) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide
PubChem CID82754385
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide
SMILESCC1CC(N)CCC1C(=O)N(C)C1CCOC1C
InChIInChI=1S/C14H26N2O2/c1-9-8-11(15)4-5-12(9)14(17)16(3)13-6-7-18-10(13)2/h9-13H,4-8,15H2,1-3H3
InChIKeyQRXQSZAFVOPSEJ-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-N,2-dimethyloxolane-3-carboxamide
CID 79750899
N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide
CID 82745104
4-amino-N,2-dimethyl-N-(3-methylcyclohexyl)cyclohexane-1-carboxamide
CID 62782752
methyl N-methyl-N-(2-methyloxolan-3-yl)carbamate
CID 116657138
4-(ethylamino)-N-methyl-N-(2-methyloxolan-3-yl)oxolane-3-carboxamide
CID 82738862
4-amino-N-[2-(dimethylamino)ethyl]-N,2-dimethylcyclohexane-1-carboxamide
CID 63727080
N-[(3-aminocyclopentyl)methyl]-N,2-dimethyloxolan-3-amine
CID 82739993
N-(8-azabicyclo[3.2.1]octan-3-yl)-N,2-dimethyloxolane-3-carboxamide
CID 79757850
(1S,2R,4R)-4-amino-2-methylcyclohexane-1-carboxylic acid
CID 162343513
N-methyl-N-(2-methyloxolan-3-yl)-2-sulfanylpropanamide
CID 107033647
2-chloro-N-methyl-N-(2-methyloxolan-3-yl)acetamide
CID 82733963
3-amino-N-methyl-N-(2-methylcyclohexyl)cyclopentane-1-carboxamide
CID 66008967

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide (CID 82754385) is 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide is CC1CC(N)CCC1C(=O)N(C)C1CCOC1C.
What is the InChIKey of 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide?
The InChIKey is QRXQSZAFVOPSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-9-8-11(15)4-5-12(9)14(17)16(3)13-6-7-18-10(13)2/h9-13H,4-8,15H2,1-3H3.
What are the key properties of 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide?
4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 82754385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).