1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine

C15H17N5 — CID 43791950

IUPAC1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine
SMILESCC(Cn1ccnc1)NCc1cnc2ccccc2n1
InChIInChI=1S/C15H17N5/c1-12(10-20-7-6-16-11-20)17-8-13-9-18-14-4-2-3-5-15(14)19-13/h2-7,9,11-12,17H,8,10H2,1H3
InChIKeyQAUUCDBLECNHIZ-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.00
Rot. Bonds5

About 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine

1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine (PubChem CID 43791950) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine
PubChem CID43791950
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine
SMILESCC(Cn1ccnc1)NCc1cnc2ccccc2n1
InChIInChI=1S/C15H17N5/c1-12(10-20-7-6-16-11-20)17-8-13-9-18-14-4-2-3-5-15(14)19-13/h2-7,9,11-12,17H,8,10H2,1H3
InChIKeyQAUUCDBLECNHIZ-UHFFFAOYSA-N
XLogP2.00
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-imidazol-1-yl-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 54958968
1-imidazol-1-yl-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
CID 78943044
4-[(1-imidazol-1-ylpropan-2-ylamino)methyl]phenol
CID 43435560
N-(quinoxalin-2-ylmethyl)hexan-2-amine
CID 55050397
4-[(1-imidazol-1-ylpropan-2-ylamino)methyl]benzene-1,3-diol
CID 43749681
1-imidazol-1-yl-N-[(4-propan-2-ylphenyl)methyl]propan-2-amine
CID 43435582
1-imidazol-1-yl-N-[(1-methylindazol-3-yl)methyl]propan-2-amine
CID 63000923
N-[[2-(1,1-difluoroethyl)phenyl]methyl]-1-imidazol-1-ylpropan-2-amine
CID 166268986
1-imidazol-1-yl-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine
CID 82893599
N-[(4-cyclopropylphenyl)methyl]-1-imidazol-1-ylpropan-2-amine
CID 79979507
1-imidazol-1-yl-N-[(4-imidazol-1-ylphenyl)methyl]propan-2-amine
CID 43435620
1-imidazol-1-yl-N-[(1-phenyltetrazol-5-yl)methyl]propan-2-amine
CID 62625643

Frequently Asked Questions

What is the IUPAC name of 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine?
The IUPAC name of 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine (CID 43791950) is 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine?
The canonical SMILES for 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine is CC(Cn1ccnc1)NCc1cnc2ccccc2n1.
What is the InChIKey of 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine?
The InChIKey is QAUUCDBLECNHIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-12(10-20-7-6-16-11-20)17-8-13-9-18-14-4-2-3-5-15(14)19-13/h2-7,9,11-12,17H,8,10H2,1H3.
What are the key properties of 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine?
1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine has a molecular weight of 267.34 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazol-1-yl-N-(quinoxalin-2-ylmethyl)propan-2-amine is sourced from PubChem (CID 43791950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).