1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide

C16H30N2O2 — CID 64549832

IUPAC1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide
SMILESCOCCN(C(=O)C1(N)CCCC(C)C1)C(C)C1CC1
InChIInChI=1S/C16H30N2O2/c1-12-5-4-8-16(17,11-12)15(19)18(9-10-20-3)13(2)14-6-7-14/h12-14H,4-11,17H2,1-3H3
InChIKeyLSIFVMQLBGRVAF-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.17
Rot. Bonds6

About 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide

1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide (PubChem CID 64549832) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide
PubChem CID64549832
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide
SMILESCOCCN(C(=O)C1(N)CCCC(C)C1)C(C)C1CC1
InChIInChI=1S/C16H30N2O2/c1-12-5-4-8-16(17,11-12)15(19)18(9-10-20-3)13(2)14-6-7-14/h12-14H,4-11,17H2,1-3H3
InChIKeyLSIFVMQLBGRVAF-UHFFFAOYSA-N
XLogP2.17
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 54872120
1-amino-N-(1-cyclopropylethyl)-3-methyl-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide
CID 64549410
1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
CID 115441735
1-amino-N-(2-hydroxyethyl)-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 64550859
1-cyano-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclobutane-1-carboxamide
CID 80597899
4-[(1-amino-3-methylcyclohexanecarbonyl)-propan-2-ylamino]butanoic acid
CID 64552529
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylpiperidine-1-carboxamide
CID 116655031
1-amino-N-(2,2-dimethylpropyl)-N-methoxy-3-methylcyclohexane-1-carboxamide
CID 114277119
2-[(1-amino-3-methylcyclohexanecarbonyl)-methylamino]acetic acid
CID 64555060
2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide
CID 60948418
1-amino-N-cyclopropyl-3-methyl-N-propylcyclohexane-1-carboxamide
CID 64550261
3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
CID 115642256

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide (CID 64549832) is 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide is COCCN(C(=O)C1(N)CCCC(C)C1)C(C)C1CC1.
What is the InChIKey of 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide?
The InChIKey is LSIFVMQLBGRVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-12-5-4-8-16(17,11-12)15(19)18(9-10-20-3)13(2)14-6-7-14/h12-14H,4-11,17H2,1-3H3.
What are the key properties of 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide?
1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide has a molecular weight of 282.43 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 64549832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).