N,1-dicyclohexyl-5-methylimidazol-2-amine

C16H27N3 — CID 135016483

IUPACN,1-dicyclohexyl-5-methylimidazol-2-amine
SMILESCc1cnc(NC2CCCCC2)n1C1CCCCC1
InChIInChI=1S/C16H27N3/c1-13-12-17-16(18-14-8-4-2-5-9-14)19(13)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3,(H,17,18)
InChIKeyHCNCQEXPKQUNMS-UHFFFAOYSA-N
MW261.41 g/mol
LogP4.44
Rot. Bonds3

About N,1-dicyclohexyl-5-methylimidazol-2-amine

N,1-dicyclohexyl-5-methylimidazol-2-amine (PubChem CID 135016483) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N,1-dicyclohexyl-5-methylimidazol-2-amine.

Molecular Properties

Compound NameN,1-dicyclohexyl-5-methylimidazol-2-amine
PubChem CID135016483
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN,1-dicyclohexyl-5-methylimidazol-2-amine
SMILESCc1cnc(NC2CCCCC2)n1C1CCCCC1
InChIInChI=1S/C16H27N3/c1-13-12-17-16(18-14-8-4-2-5-9-14)19(13)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3,(H,17,18)
InChIKeyHCNCQEXPKQUNMS-UHFFFAOYSA-N
XLogP4.44
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1-dicyclohexyl-5-methylimidazol-2-amine?
The IUPAC name of N,1-dicyclohexyl-5-methylimidazol-2-amine (CID 135016483) is N,1-dicyclohexyl-5-methylimidazol-2-amine.
What is the SMILES notation for N,1-dicyclohexyl-5-methylimidazol-2-amine?
The canonical SMILES for N,1-dicyclohexyl-5-methylimidazol-2-amine is Cc1cnc(NC2CCCCC2)n1C1CCCCC1.
What is the InChIKey of N,1-dicyclohexyl-5-methylimidazol-2-amine?
The InChIKey is HCNCQEXPKQUNMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-13-12-17-16(18-14-8-4-2-5-9-14)19(13)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3,(H,17,18).
What are the key properties of N,1-dicyclohexyl-5-methylimidazol-2-amine?
N,1-dicyclohexyl-5-methylimidazol-2-amine has a molecular weight of 261.41 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dicyclohexyl-5-methylimidazol-2-amine is sourced from PubChem (CID 135016483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).