(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine

C15H17N3 — CID 116517865

IUPAC(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine
SMILESCc1cnc(C(N)C2CC2c2ccccc2)nc1
InChIInChI=1S/C15H17N3/c1-10-8-17-15(18-9-10)14(16)13-7-12(13)11-5-3-2-4-6-11/h2-6,8-9,12-14H,7,16H2,1H3
InChIKeyYOACHVYOAXNOKP-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.59
Rot. Bonds3

About (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine

(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine (PubChem CID 116517865) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine.

Molecular Properties

Compound Name(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine
PubChem CID116517865
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine
SMILESCc1cnc(C(N)C2CC2c2ccccc2)nc1
InChIInChI=1S/C15H17N3/c1-10-8-17-15(18-9-10)14(16)13-7-12(13)11-5-3-2-4-6-11/h2-6,8-9,12-14H,7,16H2,1H3
InChIKeyYOACHVYOAXNOKP-UHFFFAOYSA-N
XLogP2.59
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 116517868
1-[(1R,2S)-2-phenylcyclopropyl]ethanamine
CID 57373127
1-(2-phenylcyclopropyl)propan-1-amine
CID 116517334
(3-methoxy-4-pyridinyl)-(2-phenylcyclopropyl)methanamine
CID 105066143
(2-bromophenyl)-[(1R,2S)-2-phenylcyclopropyl]methanamine
CID 138039926
2,3-dihydrofuran-5-yl-(2-phenylcyclopropyl)methanamine
CID 102653053
3-methyl-1-(2-phenylcyclopropyl)butan-1-amine
CID 116517331
(2-phenylcyclopropyl)-quinolin-2-ylmethanamine
CID 116517494
(2-chlorophenyl)-(2-phenylcyclopropyl)methanamine;hydrochloride
CID 138040827
(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine
CID 105018334
(5-bromothiophen-3-yl)-(2-phenylcyclopropyl)methanamine
CID 105189029
(2,4-dibromophenyl)-(2-phenylcyclopropyl)methanamine
CID 107946944

Frequently Asked Questions

What is the IUPAC name of (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine?
The IUPAC name of (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine (CID 116517865) is (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine.
What is the SMILES notation for (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine?
The canonical SMILES for (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine is Cc1cnc(C(N)C2CC2c2ccccc2)nc1.
What is the InChIKey of (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine?
The InChIKey is YOACHVYOAXNOKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-10-8-17-15(18-9-10)14(16)13-7-12(13)11-5-3-2-4-6-11/h2-6,8-9,12-14H,7,16H2,1H3.
What are the key properties of (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine?
(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine has a molecular weight of 239.32 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methanamine is sourced from PubChem (CID 116517865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).