(1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol

C13H19N5O — CID 14988407

IUPAC(1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol
SMILESCC1(NC[C@H](O)c2ccc3nnnn3c2)CCCC1
InChIInChI=1S/C13H19N5O/c1-13(6-2-3-7-13)14-8-11(19)10-4-5-12-15-16-17-18(12)9-10/h4-5,9,11,14,19H,2-3,6-8H2,1H3/t11-/m0/s1
InChIKeyPJNMNHMAQYBEJN-NSHDSACASA-N
MW261.33 g/mol
LogP1.08
Rot. Bonds4

About (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol

(1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol (PubChem CID 14988407) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol.

Molecular Properties

Compound Name(1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol
PubChem CID14988407
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name(1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol
SMILESCC1(NC[C@H](O)c2ccc3nnnn3c2)CCCC1
InChIInChI=1S/C13H19N5O/c1-13(6-2-3-7-13)14-8-11(19)10-4-5-12-15-16-17-18(12)9-10/h4-5,9,11,14,19H,2-3,6-8H2,1H3/t11-/m0/s1
InChIKeyPJNMNHMAQYBEJN-NSHDSACASA-N
XLogP1.08
TPSA75.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(1H-Pyrrolo[2,3-b]pyridin-5-yl)methanol
CID 22832050
[1,2,4]Triazolo[1,5-A]pyridin-8-ylmethanol
CID 129981074
1-(3,4-Difluorophenyl)-2-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethylamino]ethanol
CID 53498941
2-[(5-Isopropylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-1-(4-pyridinyl)ethanol
CID 56899782
L 665871
CID 130050
(1R)-2-[methyl(tetrazolo[1,5-a]pyrazin-8-yl)amino]-1-pyridin-3-ylethanol
CID 164634591
(2-Amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)(4-fluorophenyl)methanol
CID 67343283
1-(4-Fluorophenyl)-2-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethylamino]ethanol
CID 51075563
2-[(6-Fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-1-phenylethanol
CID 80048146
[1-[(6-Fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]cyclopentyl]methanol
CID 80052808
(1R)-1-(3,4-difluorophenyl)-2-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethylamino]ethanol
CID 94182393
(1S)-1-(3,4-difluorophenyl)-2-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethylamino]ethanol
CID 94182394

Frequently Asked Questions

What is the IUPAC name of (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol?
The IUPAC name of (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol (CID 14988407) is (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol.
What is the SMILES notation for (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol?
The canonical SMILES for (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol is CC1(NC[C@H](O)c2ccc3nnnn3c2)CCCC1.
What is the InChIKey of (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol?
The InChIKey is PJNMNHMAQYBEJN-NSHDSACASA-N. The full InChI is InChI=1S/C13H19N5O/c1-13(6-2-3-7-13)14-8-11(19)10-4-5-12-15-16-17-18(12)9-10/h4-5,9,11,14,19H,2-3,6-8H2,1H3/t11-/m0/s1.
What are the key properties of (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol?
(1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol has a molecular weight of 261.33 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[(1-methylcyclopentyl)amino]-1-(tetrazolo[1,5-a]pyridin-6-yl)ethanol is sourced from PubChem (CID 14988407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).