[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol

C12H18N2O — CID 63955026

IUPAC[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol
SMILESCCN(CC1CC1)c1cc(CO)ccn1
InChIInChI=1S/C12H18N2O/c1-2-14(8-10-3-4-10)12-7-11(9-15)5-6-13-12/h5-7,10,15H,2-4,8-9H2,1H3
InChIKeyWEFDQDCMMQTGIY-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.81
Rot. Bonds5

About [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol

[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol (PubChem CID 63955026) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol
PubChem CID63955026
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol
SMILESCCN(CC1CC1)c1cc(CO)ccn1
InChIInChI=1S/C12H18N2O/c1-2-14(8-10-3-4-10)12-7-11(9-15)5-6-13-12/h5-7,10,15H,2-4,8-9H2,1H3
InChIKeyWEFDQDCMMQTGIY-UHFFFAOYSA-N
XLogP1.81
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol?
The IUPAC name of [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol (CID 63955026) is [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol?
The canonical SMILES for [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol is CCN(CC1CC1)c1cc(CO)ccn1.
What is the InChIKey of [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol?
The InChIKey is WEFDQDCMMQTGIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-2-14(8-10-3-4-10)12-7-11(9-15)5-6-13-12/h5-7,10,15H,2-4,8-9H2,1H3.
What are the key properties of [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol?
[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol has a molecular weight of 206.29 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol is sourced from PubChem (CID 63955026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).