4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide

C15H30N2O3 — CID 62781952

IUPAC4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide
SMILESCOCCN(C(=O)C1CCC(N)CC1C)C(C)COC
InChIInChI=1S/C15H30N2O3/c1-11-9-13(16)5-6-14(11)15(18)17(7-8-19-3)12(2)10-20-4/h11-14H,5-10,16H2,1-4H3
InChIKeyRXOPFALTRKPRAX-UHFFFAOYSA-N
MW286.42 g/mol
LogP1.26
Rot. Bonds7

About 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide

4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide (PubChem CID 62781952) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide
PubChem CID62781952
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Name4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide
SMILESCOCCN(C(=O)C1CCC(N)CC1C)C(C)COC
InChIInChI=1S/C15H30N2O3/c1-11-9-13(16)5-6-14(11)15(18)17(7-8-19-3)12(2)10-20-4/h11-14H,5-10,16H2,1-4H3
InChIKeyRXOPFALTRKPRAX-UHFFFAOYSA-N
XLogP1.26
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-butan-2-yl-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 66010253
4-amino-2-methyl-N-pentyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 62782228
(1S,6R)-6-[2-methoxyethyl(1-methoxypropan-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 104962315
2-amino-N-(2-methoxyethyl)-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 82960939
5-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 55117060
2-amino-N-ethyl-N-(1-methoxypropan-2-yl)-5-methylcyclohexane-1-carboxamide
CID 65453971
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-4-(methylamino)oxolane-3-carboxamide
CID 66267231
4-amino-N,2-dimethyl-N-pentan-3-ylcyclohexane-1-carboxamide
CID 62783517
3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine
CID 79469576
4-(ethylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)oxolane-3-carboxamide
CID 66259105
4-amino-N-butyl-N,2-dimethylcyclohexane-1-carboxamide
CID 62781325
cis-(1S,2R)-2-[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 114091974

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide (CID 62781952) is 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide is COCCN(C(=O)C1CCC(N)CC1C)C(C)COC.
What is the InChIKey of 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide?
The InChIKey is RXOPFALTRKPRAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-11-9-13(16)5-6-14(11)15(18)17(7-8-19-3)12(2)10-20-4/h11-14H,5-10,16H2,1-4H3.
What are the key properties of 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide?
4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 1.26, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 62781952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).