1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol

C14H20N4O — CID 63772239

IUPAC1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol
SMILESCc1nn(C)c2ncc(CNCC(O)C3CC3)cc12
InChIInChI=1S/C14H20N4O/c1-9-12-5-10(7-16-14(12)18(2)17-9)6-15-8-13(19)11-3-4-11/h5,7,11,13,15,19H,3-4,6,8H2,1-2H3
InChIKeyNCLJEQIJWAIBPL-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.14
Rot. Bonds5

About 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol

1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol (PubChem CID 63772239) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol
PubChem CID63772239
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol
SMILESCc1nn(C)c2ncc(CNCC(O)C3CC3)cc12
InChIInChI=1S/C14H20N4O/c1-9-12-5-10(7-16-14(12)18(2)17-9)6-15-8-13(19)11-3-4-11/h5,7,11,13,15,19H,3-4,6,8H2,1-2H3
InChIKeyNCLJEQIJWAIBPL-UHFFFAOYSA-N
XLogP1.14
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-2,2-diethoxyethanamine
CID 112731395
1-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-2-N,2-N,3-trimethylbutane-1,2-diamine
CID 60976627
2-cyclopentyl-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]ethanamine
CID 60975729
(1S)-1-cyclopentyl-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]ethanamine
CID 81386392
(1R)-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]-1-(4-methoxyphenyl)ethanol
CID 94182625
1-[[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]methyl]cyclobutan-1-ol
CID 115621477
4-[[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]methyl]phenol
CID 115603275
2-bromo-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]prop-2-en-1-amine
CID 115614760
N-cyclopropyl-3-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide
CID 78978693
trans-(1S,2S)-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]cyclohexan-1-ol
CID 124550232
N-[2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethyl]-2-methylpropanamide
CID 60976315
cis-(1S,2R)-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-2-methylcyclopropan-1-amine
CID 124542776

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol (CID 63772239) is 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol is Cc1nn(C)c2ncc(CNCC(O)C3CC3)cc12.
What is the InChIKey of 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol?
The InChIKey is NCLJEQIJWAIBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9-12-5-10(7-16-14(12)18(2)17-9)6-15-8-13(19)11-3-4-11/h5,7,11,13,15,19H,3-4,6,8H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol?
1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol has a molecular weight of 260.34 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethanol is sourced from PubChem (CID 63772239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).