1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine

C15H16N2 — CID 129257632

IUPAC1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine
SMILESCc1ccccc1-c1ccncc1C1(N)CC1
InChIInChI=1S/C15H16N2/c1-11-4-2-3-5-12(11)13-6-9-17-10-14(13)15(16)7-8-15/h2-6,9-10H,7-8,16H2,1H3
InChIKeyUSIUJFVWXKDLFD-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.00
Rot. Bonds2

About 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine

1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine (PubChem CID 129257632) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine
PubChem CID129257632
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC Name1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine
SMILESCc1ccccc1-c1ccncc1C1(N)CC1
InChIInChI=1S/C15H16N2/c1-11-4-2-3-5-12(11)13-6-9-17-10-14(13)15(16)7-8-15/h2-6,9-10H,7-8,16H2,1H3
InChIKeyUSIUJFVWXKDLFD-UHFFFAOYSA-N
XLogP3.00
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine
CID 129257642
3-methyl-4-(2-methylphenyl)pyridine
CID 130153052
1-(3-phenyl-4-pyridinyl)cyclopropan-1-amine
CID 115008883
1-(4-ethenyl-3-pyridinyl)cyclopropan-1-amine
CID 74891778
1-(4-propan-2-yl-3-pyridinyl)cyclopropan-1-amine
CID 84767223
[4-(2-methylphenyl)-3-pyridinyl]boronic acid
CID 156775020
1-(4-ethyl-3-pyridinyl)cyclopropan-1-amine
CID 84764543
1-[2-(3-methylimidazol-4-yl)phenyl]cyclopropan-1-amine
CID 115028406
ethene;1-methyl-2-(2-methylphenyl)benzene
CID 145078997
1-(3-chloro-4-pyridinyl)cyclopropan-1-amine
CID 55297970
1-[4-(trifluoromethyl)-3-pyridinyl]cyclopropan-1-amine
CID 112706938
2-(4-methyl-3-pyridinyl)aniline
CID 65438543

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine?
The IUPAC name of 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine (CID 129257632) is 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine?
The canonical SMILES for 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine is Cc1ccccc1-c1ccncc1C1(N)CC1.
What is the InChIKey of 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine?
The InChIKey is USIUJFVWXKDLFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2/c1-11-4-2-3-5-12(11)13-6-9-17-10-14(13)15(16)7-8-15/h2-6,9-10H,7-8,16H2,1H3.
What are the key properties of 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine?
1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine has a molecular weight of 224.31 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine is sourced from PubChem (CID 129257632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).