2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol

C11H17N3O — CID 104533735

IUPAC2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
SMILESCNc1cncc(N(CCO)C2CC2)c1
InChIInChI=1S/C11H17N3O/c1-12-9-6-11(8-13-7-9)14(4-5-15)10-2-3-10/h6-8,10,12,15H,2-5H2,1H3
InChIKeyNTTIWMGMTONKQB-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.08
Rot. Bonds5

About 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol

2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol (PubChem CID 104533735) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
PubChem CID104533735
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
SMILESCNc1cncc(N(CCO)C2CC2)c1
InChIInChI=1S/C11H17N3O/c1-12-9-6-11(8-13-7-9)14(4-5-15)10-2-3-10/h6-8,10,12,15H,2-5H2,1H3
InChIKeyNTTIWMGMTONKQB-UHFFFAOYSA-N
XLogP1.08
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[cyclobutyl-[5-(methylamino)-3-pyridinyl]amino]propan-1-ol
CID 102875578
2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol
CID 104531645
5-N-cyclopentyl-3-N-methyl-5-N-(3-methylbutyl)pyridine-3,5-diamine
CID 104535326
2-[2-hydroxyethyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104533210
2-[(5-amino-3-pyridinyl)-cyclohexylamino]ethanol
CID 104533748
2-[cyclopentyl-[2-(methylamino)-4-pyridinyl]amino]ethanol
CID 113367679
5-N-cyclopropyl-5-N-(3-methylbutyl)-3-N-propylpyridine-3,5-diamine
CID 104533791
2-[cyclohexyl-[6-(methylamino)pyrazin-2-yl]amino]ethanol
CID 80811054
5-bromo-N-cyclopropyl-N-propylpyridin-3-amine
CID 104531553
3-N-methyl-5-N,5-N-dipropylpyridine-3,5-diamine
CID 104532476
2-[[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104532515
2-[methyl-[5-(methylamino)-3-pyridinyl]amino]cyclohexan-1-ol
CID 102640159

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol?
The IUPAC name of 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol (CID 104533735) is 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol is CNc1cncc(N(CCO)C2CC2)c1.
What is the InChIKey of 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol?
The InChIKey is NTTIWMGMTONKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-12-9-6-11(8-13-7-9)14(4-5-15)10-2-3-10/h6-8,10,12,15H,2-5H2,1H3.
What are the key properties of 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol?
2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol has a molecular weight of 207.28 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol is sourced from PubChem (CID 104533735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).