2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol

C11H17N3O — CID 114755799

IUPAC2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
SMILESNc1cccnc1NCC1(CCO)CC1
InChIInChI=1S/C11H17N3O/c12-9-2-1-6-13-10(9)14-8-11(3-4-11)5-7-15/h1-2,6,15H,3-5,7-8,12H2,(H,13,14)
InChIKeyKRGDJXWHZPHYMA-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.24
Rot. Bonds5

About 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol

2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol (PubChem CID 114755799) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
PubChem CID114755799
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
SMILESNc1cccnc1NCC1(CCO)CC1
InChIInChI=1S/C11H17N3O/c12-9-2-1-6-13-10(9)14-8-11(3-4-11)5-7-15/h1-2,6,15H,3-5,7-8,12H2,(H,13,14)
InChIKeyKRGDJXWHZPHYMA-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-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114757217
[2-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133496686
2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
CID 114755814
2-[1-[[[2-(methylamino)quinazolin-4-yl]amino]methyl]cyclopropyl]ethanol
CID 114759530
N-[[1-(aminomethyl)cyclopropyl]methyl]-3-fluoropyridin-2-amine
CID 115456994
1-[(3-amino-2-pyridinyl)amino]-2-methylbutan-2-ol
CID 65103157
3-[[(3-amino-2-pyridinyl)amino]methyl]pentan-3-ol
CID 65102956
3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine
CID 103794745
2-[(3-amino-2-pyridinyl)amino]acetamide
CID 14390487
2-[1-[(phthalazin-1-ylamino)methyl]cyclopropyl]ethanol
CID 114757162
[1-[[(3-fluoro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 115360754
2-[1-[[(5-chloropyrimidin-4-yl)amino]methyl]cyclopropyl]ethanol
CID 105369731

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol (CID 114755799) is 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol is Nc1cccnc1NCC1(CCO)CC1.
What is the InChIKey of 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
The InChIKey is KRGDJXWHZPHYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-9-2-1-6-13-10(9)14-8-11(3-4-11)5-7-15/h1-2,6,15H,3-5,7-8,12H2,(H,13,14).
What are the key properties of 2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol?
2-[1-[[(3-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-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol is sourced from PubChem (CID 114755799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).