2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide

C15H30N2O2 — CID 65454356

IUPAC2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide
SMILESCC(C)CCOCCNC(=O)C1CC(C)CCC1N
InChIInChI=1S/C15H30N2O2/c1-11(2)6-8-19-9-7-17-15(18)13-10-12(3)4-5-14(13)16/h11-14H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyNAHSUSGJPLVAPI-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.93
Rot. Bonds7

About 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide

2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide (PubChem CID 65454356) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide
PubChem CID65454356
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide
SMILESCC(C)CCOCCNC(=O)C1CC(C)CCC1N
InChIInChI=1S/C15H30N2O2/c1-11(2)6-8-19-9-7-17-15(18)13-10-12(3)4-5-14(13)16/h11-14H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyNAHSUSGJPLVAPI-UHFFFAOYSA-N
XLogP1.93
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-5-methylcyclohexane-1-carboxamide
CID 83117542
2-amino-5-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 65455850
2-amino-5-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]cyclohexane-1-carboxamide
CID 65456243
2-amino-5-methyl-N-(3-methylbutan-2-yl)cyclohexane-1-carboxamide
CID 65453766
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-5-methylcyclohexane-1-carboxamide
CID 65454343
2-amino-5-methyl-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
CID 65454339
2-amino-5-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)cyclohexane-1-carboxamide
CID 65456059
2-amino-5-methyl-N-pentan-3-ylcyclohexane-1-carboxamide
CID 65456041
2-amino-N-hexan-3-yl-5-methylcyclohexane-1-carboxamide
CID 65455479
2-(2-butoxyethylcarbamoyl)cyclopropane-1-carboxylic acid
CID 61171060
2-[2-(2-hydroxyethoxy)ethylcarbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 114390553
2-amino-N-ethyl-5-methyl-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 65453771

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide (CID 65454356) is 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide is CC(C)CCOCCNC(=O)C1CC(C)CCC1N.
What is the InChIKey of 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide?
The InChIKey is NAHSUSGJPLVAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-11(2)6-8-19-9-7-17-15(18)13-10-12(3)4-5-14(13)16/h11-14H,4-10,16H2,1-3H3,(H,17,18).
What are the key properties of 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide?
2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide has a molecular weight of 270.42 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methyl-N-[2-(3-methylbutoxy)ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 65454356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).