2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide

C13H25N3O — CID 64824842

IUPAC2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide
SMILESCN(CCNC(=O)C1CCCCC1N)C1CC1
InChIInChI=1S/C13H25N3O/c1-16(10-6-7-10)9-8-15-13(17)11-4-2-3-5-12(11)14/h10-12H,2-9,14H2,1H3,(H,15,17)
InChIKeyLCAUIVNYNBUUSC-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.71
Rot. Bonds5

About 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide

2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide (PubChem CID 64824842) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide
PubChem CID64824842
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide
SMILESCN(CCNC(=O)C1CCCCC1N)C1CC1
InChIInChI=1S/C13H25N3O/c1-16(10-6-7-10)9-8-15-13(17)11-4-2-3-5-12(11)14/h10-12H,2-9,14H2,1H3,(H,15,17)
InChIKeyLCAUIVNYNBUUSC-UHFFFAOYSA-N
XLogP0.71
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119878729
2-amino-N-[2-[cyclopropyl(ethyl)amino]ethyl]cyclohexane-1-carboxamide
CID 103814332
2-amino-N-[3-(dimethylamino)propyl]cyclohexane-1-carboxamide
CID 62775948
2-amino-N-[2-(diethylamino)ethyl]cyclohexane-1-carboxamide
CID 62777345
2-amino-N-(2-fluoroethyl)cyclohexane-1-carboxamide
CID 130504072
4-[2-[cyclopropyl(methyl)amino]ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63783349
cis-(1R,2S)-2-[2-[cyclopropyl(methyl)amino]ethylcarbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 114092285
2-amino-N-[3-(ethylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113410032
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]acetamide
CID 62059016
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133
2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide
CID 83021936
4-(aminomethyl)-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide
CID 79526757

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide (CID 64824842) is 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide is CN(CCNC(=O)C1CCCCC1N)C1CC1.
What is the InChIKey of 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide?
The InChIKey is LCAUIVNYNBUUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-16(10-6-7-10)9-8-15-13(17)11-4-2-3-5-12(11)14/h10-12H,2-9,14H2,1H3,(H,15,17).
What are the key properties of 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide?
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 64824842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).