2-[1-(aminomethyl)cyclopropyl]aniline

C10H14N2 — CID 82275316

IUPAC2-[1-(aminomethyl)cyclopropyl]aniline
SMILESNCC1(c2ccccc2N)CC1
InChIInChI=1S/C10H14N2/c11-7-10(5-6-10)8-3-1-2-4-9(8)12/h1-4H,5-7,11-12H2
InChIKeyHYQZRPAHRUGBHH-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.26
Rot. Bonds2

About 2-[1-(aminomethyl)cyclopropyl]aniline

2-[1-(aminomethyl)cyclopropyl]aniline (PubChem CID 82275316) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclopropyl]aniline.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclopropyl]aniline
PubChem CID82275316
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2-[1-(aminomethyl)cyclopropyl]aniline
SMILESNCC1(c2ccccc2N)CC1
InChIInChI=1S/C10H14N2/c11-7-10(5-6-10)8-3-1-2-4-9(8)12/h1-4H,5-7,11-12H2
InChIKeyHYQZRPAHRUGBHH-UHFFFAOYSA-N
XLogP1.26
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 ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclopropyl]aniline?
The IUPAC name of 2-[1-(aminomethyl)cyclopropyl]aniline (CID 82275316) is 2-[1-(aminomethyl)cyclopropyl]aniline.
What is the SMILES notation for 2-[1-(aminomethyl)cyclopropyl]aniline?
The canonical SMILES for 2-[1-(aminomethyl)cyclopropyl]aniline is NCC1(c2ccccc2N)CC1.
What is the InChIKey of 2-[1-(aminomethyl)cyclopropyl]aniline?
The InChIKey is HYQZRPAHRUGBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c11-7-10(5-6-10)8-3-1-2-4-9(8)12/h1-4H,5-7,11-12H2.
What are the key properties of 2-[1-(aminomethyl)cyclopropyl]aniline?
2-[1-(aminomethyl)cyclopropyl]aniline has a molecular weight of 162.24 g/mol, XLogP of 1.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclopropyl]aniline is sourced from PubChem (CID 82275316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).