1-nitroso-2-pyridin-3-ylethanamine

C7H9N3O — CID 154954091

IUPAC1-nitroso-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)N=O
InChIInChI=1S/C7H9N3O/c8-7(10-11)4-6-2-1-3-9-5-6/h1-3,5,7H,4,8H2
InChIKeyZYTIHCORTIKJHE-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.68
Rot. Bonds3

About 1-nitroso-2-pyridin-3-ylethanamine

1-nitroso-2-pyridin-3-ylethanamine (PubChem CID 154954091) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 1-nitroso-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-nitroso-2-pyridin-3-ylethanamine
PubChem CID154954091
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name1-nitroso-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)N=O
InChIInChI=1S/C7H9N3O/c8-7(10-11)4-6-2-1-3-9-5-6/h1-3,5,7H,4,8H2
InChIKeyZYTIHCORTIKJHE-UHFFFAOYSA-N
XLogP0.68
TPSA68.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1-pyridin-3-ylbutan-2-amine
CID 93246137
(1-amino-2-pyridin-3-ylethyl)phosphonic acid
CID 15083562
(2S)-4-methyl-1-pyridin-3-ylpentan-2-amine
CID 94470637
(1-amino-2-pyridin-3-ylethyl) formate
CID 174641191
1-amino-3-pyridin-3-ylpropan-2-ol
CID 56924494
4,4,4-trifluoro-1-pyridin-3-ylbutan-2-amine
CID 104736235
1-pyridin-3-ylpropane-2-sulfonic acid
CID 162352665
3-(2,2-dimethoxyethyl)pyridine
CID 118705230
1-propan-2-ylsulfanyl-3-pyridin-3-ylpropan-2-amine
CID 104736345
1-cyclopropyl-3-pyridin-3-ylpropan-2-amine
CID 64906812
2-methyl-1-pyridin-3-ylpentan-3-one
CID 57063498
1-cyclopentyl-2-pyridin-3-ylethanamine
CID 62553066

Frequently Asked Questions

What is the IUPAC name of 1-nitroso-2-pyridin-3-ylethanamine?
The IUPAC name of 1-nitroso-2-pyridin-3-ylethanamine (CID 154954091) is 1-nitroso-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-nitroso-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-nitroso-2-pyridin-3-ylethanamine is NC(Cc1cccnc1)N=O.
What is the InChIKey of 1-nitroso-2-pyridin-3-ylethanamine?
The InChIKey is ZYTIHCORTIKJHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c8-7(10-11)4-6-2-1-3-9-5-6/h1-3,5,7H,4,8H2.
What are the key properties of 1-nitroso-2-pyridin-3-ylethanamine?
1-nitroso-2-pyridin-3-ylethanamine has a molecular weight of 151.17 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nitroso-2-pyridin-3-ylethanamine is sourced from PubChem (CID 154954091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).