N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine

C17H24N4 — CID 106567928

IUPACN-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine
SMILESCC(Cn1ccnc1Nc1ccccc1)N1CCCCC1
InChIInChI=1S/C17H24N4/c1-15(20-11-6-3-7-12-20)14-21-13-10-18-17(21)19-16-8-4-2-5-9-16/h2,4-5,8-10,13,15H,3,6-7,11-12,14H2,1H3,(H,18,19)
InChIKeyIXBYUFCMSWPJNQ-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.50
Rot. Bonds5

About N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine

N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine (PubChem CID 106567928) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine
PubChem CID106567928
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine
SMILESCC(Cn1ccnc1Nc1ccccc1)N1CCCCC1
InChIInChI=1S/C17H24N4/c1-15(20-11-6-3-7-12-20)14-21-13-10-18-17(21)19-16-8-4-2-5-9-16/h2,4-5,8-10,13,15H,3,6-7,11-12,14H2,1H3,(H,18,19)
InChIKeyIXBYUFCMSWPJNQ-UHFFFAOYSA-N
XLogP3.50
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine?
The IUPAC name of N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine (CID 106567928) is N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine.
What is the SMILES notation for N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine?
The canonical SMILES for N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine is CC(Cn1ccnc1Nc1ccccc1)N1CCCCC1.
What is the InChIKey of N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine?
The InChIKey is IXBYUFCMSWPJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-15(20-11-6-3-7-12-20)14-21-13-10-18-17(21)19-16-8-4-2-5-9-16/h2,4-5,8-10,13,15H,3,6-7,11-12,14H2,1H3,(H,18,19).
What are the key properties of N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine?
N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine has a molecular weight of 284.41 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine is sourced from PubChem (CID 106567928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).