2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol

C11H18N2O — CID 83929964

IUPAC2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol
SMILESCC(CC(CN)CO)c1ccccn1
InChIInChI=1S/C11H18N2O/c1-9(6-10(7-12)8-14)11-4-2-3-5-13-11/h2-5,9-10,14H,6-8,12H2,1H3
InChIKeyQWOPXWNBSBOQFK-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.14
Rot. Bonds5

About 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol

2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol (PubChem CID 83929964) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol
PubChem CID83929964
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol
SMILESCC(CC(CN)CO)c1ccccn1
InChIInChI=1S/C11H18N2O/c1-9(6-10(7-12)8-14)11-4-2-3-5-13-11/h2-5,9-10,14H,6-8,12H2,1H3
InChIKeyQWOPXWNBSBOQFK-UHFFFAOYSA-N
XLogP1.14
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-2-ylpropan-1-amine
CID 21481533
2-[(2-amino-1-pyridin-2-ylethyl)-methylamino]propan-1-ol
CID 104551342
(2R)-3-methyl-2-pyridin-2-ylbutan-1-amine
CID 96736561
(2S)-2-amino-2-pyridin-2-ylethanol
CID 55278064
3-pyridin-2-ylbutane-1,2-diamine
CID 67591241
3-amino-1-pyridin-2-ylbutan-1-ol
CID 151032283
3-methyl-2-(1-pyridin-2-ylethylamino)butan-1-ol
CID 79253644
(2R)-2-amino-2-pyridin-2-ylethanol;hydrochloride
CID 86306039
3-pyridin-2-yl-1-(1,3-thiazol-2-yl)butan-1-amine
CID 57161839
(3S)-3-pyridin-2-ylbutanoic acid;sulfane
CID 167654157
2-[(2R)-pent-4-en-2-yl]pyridine
CID 134838450
4-hydroxy-4-pyridin-2-ylbutane-2-sulfonamide
CID 140565025

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol?
The IUPAC name of 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol (CID 83929964) is 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol?
The canonical SMILES for 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol is CC(CC(CN)CO)c1ccccn1.
What is the InChIKey of 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol?
The InChIKey is QWOPXWNBSBOQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9(6-10(7-12)8-14)11-4-2-3-5-13-11/h2-5,9-10,14H,6-8,12H2,1H3.
What are the key properties of 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol?
2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-pyridin-2-ylpentan-1-ol is sourced from PubChem (CID 83929964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).