2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol

C11H17N3O — CID 114755814

IUPAC2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
SMILESNc1ccc(NCC2(CCO)CC2)nc1
InChIInChI=1S/C11H17N3O/c12-9-1-2-10(13-7-9)14-8-11(3-4-11)5-6-15/h1-2,7,15H,3-6,8,12H2,(H,13,14)
InChIKeyMYBHAVFZTSQDRC-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.24
Rot. Bonds5

About 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol

2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol (PubChem CID 114755814) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
PubChem CID114755814
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
SMILESNc1ccc(NCC2(CCO)CC2)nc1
InChIInChI=1S/C11H17N3O/c12-9-1-2-10(13-7-9)14-8-11(3-4-11)5-6-15/h1-2,7,15H,3-6,8,12H2,(H,13,14)
InChIKeyMYBHAVFZTSQDRC-UHFFFAOYSA-N
XLogP1.24
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-[(4-amino-2-iodoanilino)methyl]cyclopropyl]ethanol
CID 114755784
2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
CID 114755799
2-N-ethylpyridine-2,5-diamine;hydrochloride
CID 134080457
6-[[1-(2-aminoethyl)cyclopropyl]methylamino]pyridine-3-carboxamide
CID 114759134
6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide
CID 133496605
[1-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopropyl]methanol
CID 107874814
2-[1-[(4-amino-2,6-difluoroanilino)methyl]cyclopropyl]ethanol
CID 114755776
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-5-fluoropyridin-2-amine
CID 114757767
2-[1-[[[6-(propylamino)pyrimidin-4-yl]amino]methyl]cyclopropyl]ethanol
CID 114759513
N-(3,4-difluorophenyl)-6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyridine-3-sulfonamide
CID 133496593
methyl 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyridazine-3-carboxylate
CID 114749606
N-[(1-ethylcyclopropyl)methyl]-5-methylpyridin-2-amine
CID 103736819

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol (CID 114755814) is 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol is Nc1ccc(NCC2(CCO)CC2)nc1.
What is the InChIKey of 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
The InChIKey is MYBHAVFZTSQDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-9-1-2-10(13-7-9)14-8-11(3-4-11)5-6-15/h1-2,7,15H,3-6,8,12H2,(H,13,14).
What are the key properties of 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol has a molecular weight of 207.28 g/mol, XLogP of 1.24, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol is sourced from PubChem (CID 114755814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).