[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol

C10H13FN2O — CID 164657514

IUPAC[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol
SMILESOCC1(CNc2ccncc2F)CC1
InChIInChI=1S/C10H13FN2O/c11-8-5-12-4-1-9(8)13-6-10(7-14)2-3-10/h1,4-5,14H,2-3,6-7H2,(H,12,13)
InChIKeySRIPWWAQXZCJNL-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.41
Rot. Bonds4

About [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol

[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol (PubChem CID 164657514) has the molecular formula C10H13FN2O and a molecular weight of 196.22 g/mol. Its IUPAC name is [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol
PubChem CID164657514
Molecular FormulaC10H13FN2O
Molecular Weight196.22 g/mol
Exact Mass196.10
IUPAC Name[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol
SMILESOCC1(CNc2ccncc2F)CC1
InChIInChI=1S/C10H13FN2O/c11-8-5-12-4-1-9(8)13-6-10(7-14)2-3-10/h1,4-5,14H,2-3,6-7H2,(H,12,13)
InChIKeySRIPWWAQXZCJNL-UHFFFAOYSA-N
XLogP1.41
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[[(3-bromo-4-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 104777217
[1-[[(3-chloro-4-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 112697538
3-[[1-(hydroxymethyl)cyclohexyl]methylamino]pyridine-4-carboxylic acid
CID 103968372
2-[1-[[(3-methyl-4-pyridinyl)amino]methyl]cyclopropyl]ethanol
CID 114757045
3-fluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 115362736
[1-[(2-amino-3-fluoroanilino)methyl]cyclopropyl]methanol
CID 115454133
N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine
CID 112703774
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-3-bromopyridin-4-amine
CID 114759206
3-fluoro-4-[[1-(hydroxymethyl)cyclohexyl]methylamino]benzoic acid
CID 103968375
[1-[[(3-fluoro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 115360754
[1-[(pyrazin-2-ylamino)methyl]cyclopentyl]methanol
CID 115360623
2-[1-[[(3-nitro-4-pyridinyl)amino]methyl]cyclobutyl]acetic acid
CID 81160976

Frequently Asked Questions

What is the IUPAC name of [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol (CID 164657514) is [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol is OCC1(CNc2ccncc2F)CC1.
What is the InChIKey of [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol?
The InChIKey is SRIPWWAQXZCJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c11-8-5-12-4-1-9(8)13-6-10(7-14)2-3-10/h1,4-5,14H,2-3,6-7H2,(H,12,13).
What are the key properties of [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol?
[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol has a molecular weight of 196.22 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 164657514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).