2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol

C11H16ClN3O — CID 107055331

IUPAC2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol
SMILESNCc1ccnc(N(CCO)C2CC2)c1Cl
InChIInChI=1S/C11H16ClN3O/c12-10-8(7-13)3-4-14-11(10)15(5-6-16)9-1-2-9/h3-4,9,16H,1-2,5-7,13H2
InChIKeyAOLDQPKXHSQKRX-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.15
Rot. Bonds5

About 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol

2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol (PubChem CID 107055331) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol.

Molecular Properties

Compound Name2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol
PubChem CID107055331
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol
SMILESNCc1ccnc(N(CCO)C2CC2)c1Cl
InChIInChI=1S/C11H16ClN3O/c12-10-8(7-13)3-4-14-11(10)15(5-6-16)9-1-2-9/h3-4,9,16H,1-2,5-7,13H2
InChIKeyAOLDQPKXHSQKRX-UHFFFAOYSA-N
XLogP1.15
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclobutylamino]propan-1-ol
CID 107055806
4-(aminomethyl)-3-chloro-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 107055267
2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-propan-2-ylamino]ethanol
CID 107055329
4-(aminomethyl)-3-chloro-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
CID 107055221
4-(aminomethyl)-N-butyl-N-cyclopropyl-3-fluoropyridin-2-amine
CID 105389359
4-(aminomethyl)-N-cyclopropyl-3-fluoro-N-(3-methylbutyl)pyridin-2-amine
CID 105389659
4-(aminomethyl)-3-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridin-2-amine
CID 107055363
4-(aminomethyl)-3-chloro-N-(cyclopropylmethyl)-N-ethylpyridin-2-amine
CID 107055569
4-(aminomethyl)-3-chloro-N-(cyclopentylmethyl)-N-methylpyridin-2-amine
CID 107055552
3-chloro-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-4-carboximidamide
CID 107060400
4-(aminomethyl)-3-chloro-N-(1,1-dioxothiolan-3-yl)-N-methylpyridin-2-amine
CID 107055209
2-[cyclopropyl-(3,5-dichloro-2-pyridinyl)amino]ethanol
CID 61146210

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol?
The IUPAC name of 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol (CID 107055331) is 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol.
What is the SMILES notation for 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol?
The canonical SMILES for 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol is NCc1ccnc(N(CCO)C2CC2)c1Cl.
What is the InChIKey of 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol?
The InChIKey is AOLDQPKXHSQKRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c12-10-8(7-13)3-4-14-11(10)15(5-6-16)9-1-2-9/h3-4,9,16H,1-2,5-7,13H2.
What are the key properties of 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol?
2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol has a molecular weight of 241.72 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-cyclopropylamino]ethanol is sourced from PubChem (CID 107055331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).