2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine

C13H23N3 — CID 61214730

IUPAC2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCCC1NCCc1nccn1C
InChIInChI=1S/C13H23N3/c1-11-5-3-4-6-12(11)14-8-7-13-15-9-10-16(13)2/h9-12,14H,3-8H2,1-2H3
InChIKeyNOYVIULOYKGVDQ-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.13
Rot. Bonds4

About 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine

2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine (PubChem CID 61214730) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
PubChem CID61214730
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCCC1NCCc1nccn1C
InChIInChI=1S/C13H23N3/c1-11-5-3-4-6-12(11)14-8-7-13-15-9-10-16(13)2/h9-12,14H,3-8H2,1-2H3
InChIKeyNOYVIULOYKGVDQ-UHFFFAOYSA-N
XLogP2.13
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
CID 61214993
2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 114527587
1,2,5-trimethyl-N-[2-(1-methylimidazol-2-yl)ethyl]piperidin-4-amine
CID 61212215
2-[2-(1-methylimidazol-2-yl)ethyl]-N-propylcyclohexan-1-amine
CID 114528631
2,3-dimethyl-N-[(1-methylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 43088207
N-[2-(1-methylimidazol-2-yl)ethyl]-1-azabicyclo[3.2.1]octan-4-amine
CID 105364456
4-ethyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
CID 61214727
1,2-dimethyl-N-[2-(1-methylimidazol-2-yl)ethyl]piperidin-4-amine
CID 81344994
1-methyl-N-(2-methylcyclohexyl)imidazol-2-amine
CID 62132741
3-chloro-N-[2-(1-methylimidazol-2-yl)ethyl]cyclobutan-1-amine
CID 114531771
1-cyclopentyl-3-[2-(1-methylimidazol-2-yl)ethyl]thiourea
CID 116508143
N-[2-(1-methylimidazol-2-yl)ethyl]-1,1-dioxothian-3-amine
CID 63923427

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine (CID 61214730) is 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine is CC1CCCCC1NCCc1nccn1C.
What is the InChIKey of 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine?
The InChIKey is NOYVIULOYKGVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-11-5-3-4-6-12(11)14-8-7-13-15-9-10-16(13)2/h9-12,14H,3-8H2,1-2H3.
What are the key properties of 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine?
2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine has a molecular weight of 221.35 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 61214730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).