(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine

C14H17N3 — CID 63975391

IUPAC(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine
SMILESCn1ccnc1C(N)C1(c2ccccc2)CC1
InChIInChI=1S/C14H17N3/c1-17-10-9-16-13(17)12(15)14(7-8-14)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8,15H2,1H3
InChIKeyMRZWKRWGHNCNLH-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.15
Rot. Bonds3

About (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine

(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine (PubChem CID 63975391) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine.

Molecular Properties

Compound Name(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine
PubChem CID63975391
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine
SMILESCn1ccnc1C(N)C1(c2ccccc2)CC1
InChIInChI=1S/C14H17N3/c1-17-10-9-16-13(17)12(15)14(7-8-14)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8,15H2,1H3
InChIKeyMRZWKRWGHNCNLH-UHFFFAOYSA-N
XLogP2.15
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-ethylimidazol-2-yl)-(1-phenylcyclopentyl)methanamine
CID 63968147
[1-(3,4-dichlorophenyl)cyclobutyl]-(1-methylimidazol-2-yl)methanamine
CID 13300451
1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79069821
[2-(1-methylimidazol-2-yl)-1-(1-phenylcyclobutyl)ethyl]hydrazine
CID 105217412
(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine
CID 103130824
(1R)-1-(1-methylimidazol-2-yl)ethanamine
CID 42220137
(1S)-1-(1-methylimidazol-2-yl)ethanamine;dihydrochloride
CID 162341662
1-methyl-2-(1-phenylpropyl)imidazole
CID 67056293
2,3-dihydro-1-benzothiophen-3-yl-(1-methylimidazol-2-yl)methanamine
CID 105149588
bis(1-methylimidazol-2-yl)methylhydrazine
CID 105258117
(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid
CID 26597297
1-methyl-4-[(1-methylimidazol-2-yl)-phenylmethyl]piperazine
CID 12063609

Frequently Asked Questions

What is the IUPAC name of (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine?
The IUPAC name of (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine (CID 63975391) is (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine.
What is the SMILES notation for (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine?
The canonical SMILES for (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine is Cn1ccnc1C(N)C1(c2ccccc2)CC1.
What is the InChIKey of (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine?
The InChIKey is MRZWKRWGHNCNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-17-10-9-16-13(17)12(15)14(7-8-14)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8,15H2,1H3.
What are the key properties of (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine?
(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine has a molecular weight of 227.31 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine is sourced from PubChem (CID 63975391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).