2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol

C14H17N3O — CID 151293736

IUPAC2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol
SMILESNc1ccccc1NC(CO)Cc1ccccn1
InChIInChI=1S/C14H17N3O/c15-13-6-1-2-7-14(13)17-12(10-18)9-11-5-3-4-8-16-11/h1-8,12,17-18H,9-10,15H2
InChIKeyOAYULRUBBZQXQJ-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.68
Rot. Bonds5

About 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol

2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol (PubChem CID 151293736) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol
PubChem CID151293736
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol
SMILESNc1ccccc1NC(CO)Cc1ccccn1
InChIInChI=1S/C14H17N3O/c15-13-6-1-2-7-14(13)17-12(10-18)9-11-5-3-4-8-16-11/h1-8,12,17-18H,9-10,15H2
InChIKeyOAYULRUBBZQXQJ-UHFFFAOYSA-N
XLogP1.68
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-(4-fluoro-2-nitroanilino)-3-pyridin-2-ylpropan-1-ol
CID 99794888
2-amino-3-pyridin-2-ylpropan-1-ol;hydrochloride
CID 75525879
(2R)-2-[2-nitro-4-(trifluoromethylsulfonyl)anilino]-3-pyridin-2-ylpropan-1-ol
CID 99794892
(2S)-2-[2-nitro-4-(trifluoromethylsulfonyl)anilino]-3-pyridin-2-ylpropan-1-ol
CID 99794891
2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide
CID 91652329
(4-methyl-1-pyridin-2-ylpentan-2-yl)hydrazine
CID 105198827
1-pyridin-2-ylpentan-2-ylhydrazine
CID 105199777
(2S)-2-(4-nitro-2-pyrrolidin-1-ylsulfonylanilino)-3-pyridin-2-ylpropan-1-ol
CID 99794893
N-(2-aminophenyl)-2-pyridin-2-ylethanesulfonamide
CID 60864371
(5-methyl-1-pyridin-2-ylhexan-2-yl)hydrazine
CID 105199745
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
(2S)-2-[(3-methoxyphenyl)methylamino]-3-pyridin-2-ylpropan-1-ol
CID 122589547

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol?
The IUPAC name of 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol (CID 151293736) is 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol?
The canonical SMILES for 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol is Nc1ccccc1NC(CO)Cc1ccccn1.
What is the InChIKey of 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol?
The InChIKey is OAYULRUBBZQXQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c15-13-6-1-2-7-14(13)17-12(10-18)9-11-5-3-4-8-16-11/h1-8,12,17-18H,9-10,15H2.
What are the key properties of 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol?
2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol has a molecular weight of 243.31 g/mol, XLogP of 1.68, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoanilino)-3-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 151293736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).