N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine

C17H31N3 — CID 64764623

IUPACN,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine
SMILESCCCn1ccnc1C(C)(C)C1CCC(C)CC1NC
InChIInChI=1S/C17H31N3/c1-6-10-20-11-9-19-16(20)17(3,4)14-8-7-13(2)12-15(14)18-5/h9,11,13-15,18H,6-8,10,12H2,1-5H3
InChIKeySZHQKIRNJJSRDW-UHFFFAOYSA-N
MW277.46 g/mol
LogP3.59
Rot. Bonds5

About N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine

N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine (PubChem CID 64764623) has the molecular formula C17H31N3 and a molecular weight of 277.46 g/mol. Its IUPAC name is N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine
PubChem CID64764623
Molecular FormulaC17H31N3
Molecular Weight277.46 g/mol
Exact Mass277.25
IUPAC NameN,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine
SMILESCCCn1ccnc1C(C)(C)C1CCC(C)CC1NC
InChIInChI=1S/C17H31N3/c1-6-10-20-11-9-19-16(20)17(3,4)14-8-7-13(2)12-15(14)18-5/h9,11,13-15,18H,6-8,10,12H2,1-5H3
InChIKeySZHQKIRNJJSRDW-UHFFFAOYSA-N
XLogP3.59
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.46
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-ol
CID 64766250
N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581825
2-[2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 114664693
N-[2-(4-methylcyclohexyl)ethyl]-1-propylimidazol-2-amine
CID 106574294
N-methyl-1-(3-methylcyclopentyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79762352
3-methyl-N-[(1-propylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 62955948
3-(1-propylimidazol-2-yl)pentan-3-ol
CID 63974999
N,5-dimethyl-2-[2-methyl-1-(1,3-thiazol-2-yl)propan-2-yl]cyclohexan-1-amine
CID 79825191
2-[2-(3-fluoro-5-methylphenyl)propan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 79705337
2-[2-(furan-3-yl)propan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64764252
N-ethyl-2-methyl-3-(1-propylimidazol-2-yl)cyclopentan-1-amine
CID 64907687
5-methyl-3-[2-[4-methyl-2-(methylamino)cyclohexyl]propan-2-yl]pyridin-2-amine
CID 64763897

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine?
The IUPAC name of N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine (CID 64764623) is N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine.
What is the SMILES notation for N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine?
The canonical SMILES for N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine is CCCn1ccnc1C(C)(C)C1CCC(C)CC1NC.
What is the InChIKey of N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine?
The InChIKey is SZHQKIRNJJSRDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3/c1-6-10-20-11-9-19-16(20)17(3,4)14-8-7-13(2)12-15(14)18-5/h9,11,13-15,18H,6-8,10,12H2,1-5H3.
What are the key properties of N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine?
N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine has a molecular weight of 277.46 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-[2-(1-propylimidazol-2-yl)propan-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 64764623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).