(2,6-diamino-1H-pyridin-2-yl)methanol

C6H11N3O — CID 170695917

IUPAC(2,6-diamino-1H-pyridin-2-yl)methanol
SMILESNC1=CC=CC(N)(CO)N1
InChIInChI=1S/C6H11N3O/c7-5-2-1-3-6(8,4-10)9-5/h1-3,9-10H,4,7-8H2
InChIKeyKTAAPAOTGNNMKU-UHFFFAOYSA-N
MW141.17 g/mol
LogP-1.41
Rot. Bonds1

About (2,6-diamino-1H-pyridin-2-yl)methanol

(2,6-diamino-1H-pyridin-2-yl)methanol (PubChem CID 170695917) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is (2,6-diamino-1H-pyridin-2-yl)methanol.

Molecular Properties

Compound Name(2,6-diamino-1H-pyridin-2-yl)methanol
PubChem CID170695917
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name(2,6-diamino-1H-pyridin-2-yl)methanol
SMILESNC1=CC=CC(N)(CO)N1
InChIInChI=1S/C6H11N3O/c7-5-2-1-3-6(8,4-10)9-5/h1-3,9-10H,4,7-8H2
InChIKeyKTAAPAOTGNNMKU-UHFFFAOYSA-N
XLogP-1.41
TPSA84.30 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-1.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

[(1R)-1-amino-5-chlorocyclohexa-2,4-dien-1-yl]methanol
CID 173234020
[1,6-bis(hydroxymethyl)-7-oxabicyclo[4.1.0]hepta-2,4-dien-2-yl]methanol
CID 141334868
5-amino-5,6-dimethylcyclohexa-1,3-dien-1-ol
CID 67535998
1-amino-5,6-dimethylcyclohexa-2,4-dien-1-ol
CID 70634940
6-ethoxycarbonyl-2-methyl-1H-pyridine-2-carboxylic acid
CID 86659766
2-N,2,3-trimethyl-1H-pyridine-2,6-diamine
CID 174764195
(3S,4R,5S)-2-amino-2-(hydroxymethyl)oxane-3,4,5-triol
CID 148549511
5,5,6-triaminocyclohexa-1,3-diene-1-carboxylic acid
CID 141270377
7-propan-2-yl-1H-azepin-2-amine
CID 174815984
2-[6-amino-2-fluoro-6-(2-hydroxyethyl)cyclohexa-2,4-dien-1-yl]ethanol
CID 154426192
[1-(3-chloropropoxy)-6-methyl-5-phenylcyclohexa-2,4-dien-1-yl]methanol
CID 175341325
2,6-dipentyl-1H-pyridine-2-carboxylic acid
CID 70482492

Frequently Asked Questions

What is the IUPAC name of (2,6-diamino-1H-pyridin-2-yl)methanol?
The IUPAC name of (2,6-diamino-1H-pyridin-2-yl)methanol (CID 170695917) is (2,6-diamino-1H-pyridin-2-yl)methanol.
What is the SMILES notation for (2,6-diamino-1H-pyridin-2-yl)methanol?
The canonical SMILES for (2,6-diamino-1H-pyridin-2-yl)methanol is NC1=CC=CC(N)(CO)N1.
What is the InChIKey of (2,6-diamino-1H-pyridin-2-yl)methanol?
The InChIKey is KTAAPAOTGNNMKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c7-5-2-1-3-6(8,4-10)9-5/h1-3,9-10H,4,7-8H2.
What are the key properties of (2,6-diamino-1H-pyridin-2-yl)methanol?
(2,6-diamino-1H-pyridin-2-yl)methanol has a molecular weight of 141.17 g/mol, XLogP of -1.41, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-diamino-1H-pyridin-2-yl)methanol is sourced from PubChem (CID 170695917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).