[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol

C9H12F2N2O — CID 130088446

IUPAC[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol
SMILESCc1c(C(F)F)cc(CO)nc1CN
InChIInChI=1S/C9H12F2N2O/c1-5-7(9(10)11)2-6(4-14)13-8(5)3-12/h2,9,14H,3-4,12H2,1H3
InChIKeyKCOIEKIIYXQYER-UHFFFAOYSA-N
MW202.20 g/mol
LogP1.28
Rot. Bonds3

About [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol

[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol (PubChem CID 130088446) has the molecular formula C9H12F2N2O and a molecular weight of 202.20 g/mol. Its IUPAC name is [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol
PubChem CID130088446
Molecular FormulaC9H12F2N2O
Molecular Weight202.20 g/mol
Exact Mass202.09
IUPAC Name[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol
SMILESCc1c(C(F)F)cc(CO)nc1CN
InChIInChI=1S/C9H12F2N2O/c1-5-7(9(10)11)2-6(4-14)13-8(5)3-12/h2,9,14H,3-4,12H2,1H3
InChIKeyKCOIEKIIYXQYER-UHFFFAOYSA-N
XLogP1.28
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(aminomethyl)-4-(difluoromethyl)-5-iodo-2-pyridinyl]methanol
CID 130086878
[4-(difluoromethyl)-6-methoxy-5-methyl-2-pyridinyl]methanol
CID 118806611
[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 118829480
[4-(difluoromethyl)-5-iodo-6-methyl-2-pyridinyl]methanol
CID 118800735
4-(difluoromethyl)-6-(hydroxymethyl)-3-methylpyridine-2-carbonitrile
CID 118991281
4-(difluoromethyl)-6-(hydroxymethyl)-2-methylpyridin-3-ol
CID 118834562
[6-(aminomethyl)-5-(difluoromethyl)-2-methyl-3-pyridinyl]methanol
CID 118847964
[4-(difluoromethyl)-3-methyl-6-nitro-2-pyridinyl]methanamine
CID 118814451
[6-bromo-4-(difluoromethyl)-3-methyl-2-pyridinyl]methanol
CID 130069331
[6-(aminomethyl)-3-chloro-4-(difluoromethyl)-2-pyridinyl]methanol
CID 130074984
[6-chloro-4-(difluoromethyl)-5-iodo-2-pyridinyl]methanol
CID 130073268
[4-(difluoromethyl)-5-fluoro-6-methoxy-2-pyridinyl]methanol
CID 118846106

Frequently Asked Questions

What is the IUPAC name of [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol?
The IUPAC name of [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol (CID 130088446) is [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol.
What is the SMILES notation for [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol?
The canonical SMILES for [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol is Cc1c(C(F)F)cc(CO)nc1CN.
What is the InChIKey of [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol?
The InChIKey is KCOIEKIIYXQYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2O/c1-5-7(9(10)11)2-6(4-14)13-8(5)3-12/h2,9,14H,3-4,12H2,1H3.
What are the key properties of [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol?
[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol has a molecular weight of 202.20 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol is sourced from PubChem (CID 130088446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).