[2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol

C13H20N2O — CID 61445710

IUPAC[2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol
SMILESCCCCN(c1ncccc1CO)C1CC1
InChIInChI=1S/C13H20N2O/c1-2-3-9-15(12-6-7-12)13-11(10-16)5-4-8-14-13/h4-5,8,12,16H,2-3,6-7,9-10H2,1H3
InChIKeyGILKKKYFMRUEKL-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.34
Rot. Bonds6

About [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol

[2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol (PubChem CID 61445710) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol
PubChem CID61445710
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name[2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol
SMILESCCCCN(c1ncccc1CO)C1CC1
InChIInChI=1S/C13H20N2O/c1-2-3-9-15(12-6-7-12)13-11(10-16)5-4-8-14-13/h4-5,8,12,16H,2-3,6-7,9-10H2,1H3
InChIKeyGILKKKYFMRUEKL-UHFFFAOYSA-N
XLogP2.34
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[cyclopropyl(ethyl)amino]-3-pyridinyl]methanol
CID 61257683
3-[cyclobutyl-[3-(hydroxymethyl)-2-pyridinyl]amino]propan-1-ol
CID 102869240
3-(2-aminopropyl)-N-butyl-N-cyclopropylpyridin-2-amine
CID 114057413
[1-[butyl(cyclopropyl)amino]isoquinolin-4-yl]methanol
CID 106768094
3-(chloromethyl)-N-cyclopropyl-N-propylpyridin-2-amine
CID 61255764
[2-[methyl(pentyl)amino]-3-pyridinyl]methanol
CID 61256458
4-(aminomethyl)-N-butyl-N-cyclopropyl-3-fluoropyridin-2-amine
CID 105389359
[2-[methyl(propyl)amino]-3-pyridinyl]methanol
CID 61255175
[2-[cyclohexyl(methyl)amino]-3-pyridinyl]methanol
CID 61252621
2-[cyclopropyl(propyl)amino]pyridine-3-carbonitrile
CID 43270562
1-[2-[cyclobutyl(3-hydroxypropyl)amino]-3-pyridinyl]ethanone
CID 114055612
[4-bromo-2-[butyl(cyclopropyl)amino]phenyl]methanol
CID 61445229

Frequently Asked Questions

What is the IUPAC name of [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol?
The IUPAC name of [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol (CID 61445710) is [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol?
The canonical SMILES for [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol is CCCCN(c1ncccc1CO)C1CC1.
What is the InChIKey of [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol?
The InChIKey is GILKKKYFMRUEKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-3-9-15(12-6-7-12)13-11(10-16)5-4-8-14-13/h4-5,8,12,16H,2-3,6-7,9-10H2,1H3.
What are the key properties of [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol?
[2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol has a molecular weight of 220.32 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[butyl(cyclopropyl)amino]-3-pyridinyl]methanol is sourced from PubChem (CID 61445710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).