1-[4-(aminomethyl)phenyl]cyclopropan-1-amine

C10H14N2 — CID 55270414

IUPAC1-[4-(aminomethyl)phenyl]cyclopropan-1-amine
SMILESNCc1ccc(C2(N)CC2)cc1
InChIInChI=1S/C10H14N2/c11-7-8-1-3-9(4-2-8)10(12)5-6-10/h1-4H,5-7,11-12H2
InChIKeyXBWLISAZXHYLPF-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.09
Rot. Bonds2

About 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine

1-[4-(aminomethyl)phenyl]cyclopropan-1-amine (PubChem CID 55270414) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[4-(aminomethyl)phenyl]cyclopropan-1-amine
PubChem CID55270414
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name1-[4-(aminomethyl)phenyl]cyclopropan-1-amine
SMILESNCc1ccc(C2(N)CC2)cc1
InChIInChI=1S/C10H14N2/c11-7-8-1-3-9(4-2-8)10(12)5-6-10/h1-4H,5-7,11-12H2
InChIKeyXBWLISAZXHYLPF-UHFFFAOYSA-N
XLogP1.09
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine?
The IUPAC name of 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine (CID 55270414) is 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine?
The canonical SMILES for 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine is NCc1ccc(C2(N)CC2)cc1.
What is the InChIKey of 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine?
The InChIKey is XBWLISAZXHYLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c11-7-8-1-3-9(4-2-8)10(12)5-6-10/h1-4H,5-7,11-12H2.
What are the key properties of 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine?
1-[4-(aminomethyl)phenyl]cyclopropan-1-amine has a molecular weight of 162.24 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(aminomethyl)phenyl]cyclopropan-1-amine is sourced from PubChem (CID 55270414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).