5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine

C14H22FN3 — CID 106642977

IUPAC5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
SMILESCC(C)N(CC1CCCNC1)c1ccc(F)cn1
InChIInChI=1S/C14H22FN3/c1-11(2)18(10-12-4-3-7-16-8-12)14-6-5-13(15)9-17-14/h5-6,9,11-12,16H,3-4,7-8,10H2,1-2H3
InChIKeyBEYHXEUNZGVWTL-UHFFFAOYSA-N
MW251.35 g/mol
LogP2.44
Rot. Bonds4

About 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine

5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine (PubChem CID 106642977) has the molecular formula C14H22FN3 and a molecular weight of 251.35 g/mol. Its IUPAC name is 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
PubChem CID106642977
Molecular FormulaC14H22FN3
Molecular Weight251.35 g/mol
Exact Mass251.18
IUPAC Name5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
SMILESCC(C)N(CC1CCCNC1)c1ccc(F)cn1
InChIInChI=1S/C14H22FN3/c1-11(2)18(10-12-4-3-7-16-8-12)14-6-5-13(15)9-17-14/h5-6,9,11-12,16H,3-4,7-8,10H2,1-2H3
InChIKeyBEYHXEUNZGVWTL-UHFFFAOYSA-N
XLogP2.44
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-fluoro-N-(piperidin-3-ylmethyl)pyridin-2-amine
CID 106643283
N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrazin-2-amine
CID 106643250
N-[1-(5-fluoro-2-pyridinyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106624899
6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106643185
N-(piperidin-3-ylmethyl)-N-propan-2-yl-6-propylpyrimidin-4-amine
CID 106643142
6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine
CID 106643134
1-(4-fluorophenyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 106623943
4-[piperidin-3-ylmethyl(propan-2-yl)amino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136805343
4-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106643074
1-(4-fluorophenyl)-N,2-dimethyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 120849617
4-ethoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106643233
6-[piperidin-4-ylmethyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 79719998

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine (CID 106642977) is 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine is CC(C)N(CC1CCCNC1)c1ccc(F)cn1.
What is the InChIKey of 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is BEYHXEUNZGVWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FN3/c1-11(2)18(10-12-4-3-7-16-8-12)14-6-5-13(15)9-17-14/h5-6,9,11-12,16H,3-4,7-8,10H2,1-2H3.
What are the key properties of 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 251.35 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 106642977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).