(R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine

C11H12BrN3 — CID 42220181

IUPAC(R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine
SMILESCn1ccnc1[C@H](N)c1ccc(Br)cc1
InChIInChI=1S/C11H12BrN3/c1-15-7-6-14-11(15)10(13)8-2-4-9(12)5-3-8/h2-7,10H,13H2,1H3/t10-/m1/s1
InChIKeyRHKXPAYMJZSTCE-SNVBAGLBSA-N
MW266.14 g/mol
LogP2.23
Rot. Bonds2

About (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine

(R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine (PubChem CID 42220181) has the molecular formula C11H12BrN3 and a molecular weight of 266.14 g/mol. Its IUPAC name is (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine.

Molecular Properties

Compound Name(R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine
PubChem CID42220181
Molecular FormulaC11H12BrN3
Molecular Weight266.14 g/mol
Exact Mass265.02
IUPAC Name(R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine
SMILESCn1ccnc1[C@H](N)c1ccc(Br)cc1
InChIInChI=1S/C11H12BrN3/c1-15-7-6-14-11(15)10(13)8-2-4-9(12)5-3-8/h2-7,10H,13H2,1H3/t10-/m1/s1
InChIKeyRHKXPAYMJZSTCE-SNVBAGLBSA-N
XLogP2.23
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-2-methylphenyl)-(1-methylimidazol-2-yl)methanamine
CID 65312123
3-(4-bromophenyl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 115053222
(3-chloro-4-methylphenyl)-(1-methylimidazol-2-yl)methanamine
CID 63195529
(3,4-dimethoxyphenyl)-(1-methylimidazol-2-yl)methanamine;hydrochloride
CID 52983573
(S)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methanamine
CID 9115286
(1R)-1-(1-methylimidazol-2-yl)ethanamine
CID 42220137
(1S)-1-(1-methylimidazol-2-yl)ethanamine;dihydrochloride
CID 162341662
(6-bromonaphthalen-2-yl)-(1-propylimidazol-2-yl)methanamine
CID 115354391
(1-methylimidazol-2-yl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116544947
N-[1-(4-bromophenyl)ethyl]-1-methylimidazol-2-amine
CID 62133310
(3-bromo-2,4-dimethoxyphenyl)-(1-methylimidazol-2-yl)methanamine
CID 103523504
2-(3-bromophenyl)sulfanyl-1-(1-methylimidazol-2-yl)ethanamine
CID 66161180

Frequently Asked Questions

What is the IUPAC name of (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine?
The IUPAC name of (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine (CID 42220181) is (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine.
What is the SMILES notation for (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine?
The canonical SMILES for (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine is Cn1ccnc1[C@H](N)c1ccc(Br)cc1.
What is the InChIKey of (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine?
The InChIKey is RHKXPAYMJZSTCE-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H12BrN3/c1-15-7-6-14-11(15)10(13)8-2-4-9(12)5-3-8/h2-7,10H,13H2,1H3/t10-/m1/s1.
What are the key properties of (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine?
(R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine has a molecular weight of 266.14 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-bromophenyl)-(1-methylimidazol-2-yl)methanamine is sourced from PubChem (CID 42220181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).