1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine

C12H15N — CID 105435585

IUPAC1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine
SMILESCc1ccccc1/C=C/C1(N)CC1
InChIInChI=1S/C12H15N/c1-10-4-2-3-5-11(10)6-7-12(13)8-9-12/h2-7H,8-9,13H2,1H3/b7-6+
InChIKeyJNIWDNSWPJHXNC-VOTSOKGWSA-N
MW173.26 g/mol
LogP2.50
Rot. Bonds2

About 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine

1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine (PubChem CID 105435585) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine
PubChem CID105435585
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine
SMILESCc1ccccc1/C=C/C1(N)CC1
InChIInChI=1S/C12H15N/c1-10-4-2-3-5-11(10)6-7-12(13)8-9-12/h2-7H,8-9,13H2,1H3/b7-6+
InChIKeyJNIWDNSWPJHXNC-VOTSOKGWSA-N
XLogP2.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-2-[6-(2-methylphenyl)hexa-1,3,5-trienyl]benzene
CID 2729839
4-[(Z)-2-(2-methylphenyl)ethenyl]aniline
CID 58868755
ethane;1-methyl-2-[(Z)-prop-1-enyl]benzene
CID 145388668
5,11,13,15-tetrakis[(E)-2-(2-methylphenyl)ethenyl]tricyclo[8.2.2.24,7]hexadeca-1(12),4(16),5,7(15),10,13-hexaene
CID 10604517
2-methyl-4-[(E)-2-(2-methylphenyl)ethenyl]aniline
CID 137498181
3-[2-(2-methylphenyl)ethenyl]aniline
CID 86115385
N-[(Z)-2-(2-methylphenyl)ethenyl]methanimine
CID 129049120
(E)-1-(3-hydroxy-3-methylpyrrolidin-1-yl)-3-(2-methylphenyl)prop-2-en-1-one
CID 113253546
2-methylprop-1-ene;1-methyl-2-[(Z)-prop-1-enyl]benzene
CID 144743897
(Z)-4-(2-methylphenyl)but-3-enal
CID 117268062
(E)-(2-methylphenyl)methylidenehydrazine
CID 22712356
ethyl 4-(2-methylphenyl)but-3-enoate
CID 86054840

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine?
The IUPAC name of 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine (CID 105435585) is 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine?
The canonical SMILES for 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine is Cc1ccccc1/C=C/C1(N)CC1.
What is the InChIKey of 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine?
The InChIKey is JNIWDNSWPJHXNC-VOTSOKGWSA-N. The full InChI is InChI=1S/C12H15N/c1-10-4-2-3-5-11(10)6-7-12(13)8-9-12/h2-7H,8-9,13H2,1H3/b7-6+.
What are the key properties of 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine?
1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine has a molecular weight of 173.26 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-(2-methylphenyl)ethenyl]cyclopropan-1-amine is sourced from PubChem (CID 105435585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).