3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol

C9H13ClN2O — CID 64666699

IUPAC3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol
SMILESCC(CO)Cc1cc(Cl)cnc1N
InChIInChI=1S/C9H13ClN2O/c1-6(5-13)2-7-3-8(10)4-12-9(7)11/h3-4,6,13H,2,5H2,1H3,(H2,11,12)
InChIKeyRMNRTCHDHWVBSV-UHFFFAOYSA-N
MW200.67 g/mol
LogP1.49
Rot. Bonds3

About 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol

3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol (PubChem CID 64666699) has the molecular formula C9H13ClN2O and a molecular weight of 200.67 g/mol. Its IUPAC name is 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol
PubChem CID64666699
Molecular FormulaC9H13ClN2O
Molecular Weight200.67 g/mol
Exact Mass200.07
IUPAC Name3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol
SMILESCC(CO)Cc1cc(Cl)cnc1N
InChIInChI=1S/C9H13ClN2O/c1-6(5-13)2-7-3-8(10)4-12-9(7)11/h3-4,6,13H,2,5H2,1H3,(H2,11,12)
InChIKeyRMNRTCHDHWVBSV-UHFFFAOYSA-N
XLogP1.49
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.67
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(6-Amino-5-chloro-3-pyridinyl)methyl]-3-propanoylselanylpropanoic acid
CID 145961938
3-(5-Chloro-2-guanidino-pyridin-3-yl)-propionic acid
CID 44298459
Ethyl 2-[(6-amino-5-chloro-3-pyridinyl)methyl]-3-propanoylselanylpropanoate
CID 66563346
3-(6-Chloropyridin-3-yl)propan-1-ol
CID 14071569
(6-Amino-5-chloropyridin-3-yl)methanol
CID 17883579
5-Chloro-3-ethylpyridin-2-amine
CID 53307410
5-Chloro-3-(propan-2-yl)pyridin-2-amine
CID 58751475
(1-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)piperidin-3-yl)methanol
CID 4850834
{1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-3-ethyl-3-piperidinyl}methanol
CID 45932493
3-(2-Amino-5-iodopyridin-3-yl)propan-1-ol
CID 46318126
(2S)-2-[(6-amino-5-chloro-3-pyridinyl)methyl]-3-selanylpropanoic acid
CID 137348797
5-Chloro-6-[[2-(hydroxymethyl)cyclohexyl]amino]pyridine-3-carbonitrile
CID 72004360

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol?
The IUPAC name of 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol (CID 64666699) is 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol.
What is the SMILES notation for 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol?
The canonical SMILES for 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol is CC(CO)Cc1cc(Cl)cnc1N.
What is the InChIKey of 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol?
The InChIKey is RMNRTCHDHWVBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN2O/c1-6(5-13)2-7-3-8(10)4-12-9(7)11/h3-4,6,13H,2,5H2,1H3,(H2,11,12).
What are the key properties of 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol?
3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol has a molecular weight of 200.67 g/mol, XLogP of 1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol is sourced from PubChem (CID 64666699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).