3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine

C10H13FN2O — CID 130678795

IUPAC3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine
SMILESFc1cnccc1NCC1CCOC1
InChIInChI=1S/C10H13FN2O/c11-9-6-12-3-1-10(9)13-5-8-2-4-14-7-8/h1,3,6,8H,2,4-5,7H2,(H,12,13)
InChIKeyWRTGERPRGJYSMK-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.67
Rot. Bonds3

About 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine

3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine (PubChem CID 130678795) has the molecular formula C10H13FN2O and a molecular weight of 196.22 g/mol. Its IUPAC name is 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine.

Molecular Properties

Compound Name3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine
PubChem CID130678795
Molecular FormulaC10H13FN2O
Molecular Weight196.22 g/mol
Exact Mass196.10
IUPAC Name3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine
SMILESFc1cnccc1NCC1CCOC1
InChIInChI=1S/C10H13FN2O/c11-9-6-12-3-1-10(9)13-5-8-2-4-14-7-8/h1,3,6,8H,2,4-5,7H2,(H,12,13)
InChIKeyWRTGERPRGJYSMK-UHFFFAOYSA-N
XLogP1.67
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-(oxolan-3-ylmethyl)pyridin-4-amine
CID 104776871
2,5-difluoro-N-(oxolan-3-ylmethyl)aniline
CID 43192592
3-fluoro-4-(oxolan-3-ylmethylamino)benzonitrile
CID 61040182
4-chloro-2-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-5-[[(3R)-oxan-3-yl]methylamino]pyridazin-3-one
CID 168964255
2-bromo-5-fluoro-N-(oxolan-3-ylmethyl)aniline
CID 104843497
4-fluoro-2-iodo-N-(oxolan-3-ylmethyl)aniline
CID 79769061
3-(oxan-4-ylmethylamino)pyridine-4-carbothioamide
CID 113269693
N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine
CID 112703774
2,5-dichloro-N-(oxolan-3-ylmethyl)aniline
CID 43191026
4-fluoro-3-(oxolan-3-ylmethylamino)benzoic acid
CID 43728204
N-(oxolan-3-ylmethyl)-2-(trifluoromethyl)aniline
CID 43191959
2,3-difluoro-4-(oxolan-3-ylmethylamino)benzonitrile
CID 114017704

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine?
The IUPAC name of 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine (CID 130678795) is 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine.
What is the SMILES notation for 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine?
The canonical SMILES for 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine is Fc1cnccc1NCC1CCOC1.
What is the InChIKey of 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine?
The InChIKey is WRTGERPRGJYSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c11-9-6-12-3-1-10(9)13-5-8-2-4-14-7-8/h1,3,6,8H,2,4-5,7H2,(H,12,13).
What are the key properties of 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine?
3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine has a molecular weight of 196.22 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine is sourced from PubChem (CID 130678795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).