[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol

C12H18N2O — CID 63864667

IUPAC[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol
SMILESCC1CC1CN(C)c1cc(CO)ccn1
InChIInChI=1S/C12H18N2O/c1-9-5-11(9)7-14(2)12-6-10(8-15)3-4-13-12/h3-4,6,9,11,15H,5,7-8H2,1-2H3
InChIKeyNVQLFBTYVHYIFA-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.67
Rot. Bonds4

About [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol

[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol (PubChem CID 63864667) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol
PubChem CID63864667
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol
SMILESCC1CC1CN(C)c1cc(CO)ccn1
InChIInChI=1S/C12H18N2O/c1-9-5-11(9)7-14(2)12-6-10(8-15)3-4-13-12/h3-4,6,9,11,15H,5,7-8H2,1-2H3
InChIKeyNVQLFBTYVHYIFA-UHFFFAOYSA-N
XLogP1.67
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol?
The IUPAC name of [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol (CID 63864667) is [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol?
The canonical SMILES for [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol is CC1CC1CN(C)c1cc(CO)ccn1.
What is the InChIKey of [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol?
The InChIKey is NVQLFBTYVHYIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-5-11(9)7-14(2)12-6-10(8-15)3-4-13-12/h3-4,6,9,11,15H,5,7-8H2,1-2H3.
What are the key properties of [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol?
[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol has a molecular weight of 206.29 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol is sourced from PubChem (CID 63864667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).