[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol

C11H16N2O — CID 105446398

IUPAC[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol
SMILESNC1(CCc2ccnc(CO)c2)CC1
InChIInChI=1S/C11H16N2O/c12-11(4-5-11)3-1-9-2-6-13-10(7-9)8-14/h2,6-7,14H,1,3-5,8,12H2
InChIKeyLQKNTZLRVVRILS-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.00
Rot. Bonds4

About [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol

[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol (PubChem CID 105446398) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol
PubChem CID105446398
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol
SMILESNC1(CCc2ccnc(CO)c2)CC1
InChIInChI=1S/C11H16N2O/c12-11(4-5-11)3-1-9-2-6-13-10(7-9)8-14/h2,6-7,14H,1,3-5,8,12H2
InChIKeyLQKNTZLRVVRILS-UHFFFAOYSA-N
XLogP1.00
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol?
The IUPAC name of [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol (CID 105446398) is [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol.
What is the SMILES notation for [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol?
The canonical SMILES for [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol is NC1(CCc2ccnc(CO)c2)CC1.
What is the InChIKey of [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol?
The InChIKey is LQKNTZLRVVRILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c12-11(4-5-11)3-1-9-2-6-13-10(7-9)8-14/h2,6-7,14H,1,3-5,8,12H2.
What are the key properties of [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol?
[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol has a molecular weight of 192.26 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol is sourced from PubChem (CID 105446398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).