N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride

C18H23Cl2N3O2 — CID 119460334

IUPACN-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride
SMILESCl.Cl.O=C(NCC1CCCNC1)c1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C18H21N3O2.2ClH/c22-18(21-12-14-3-1-9-19-11-14)15-5-7-16(8-6-15)23-17-4-2-10-20-13-17;;/h2,4-8,10,13-14,19H,1,3,9,11-12H2,(H,21,22);2*1H
InChIKeyOKMZPINFIWXBFH-UHFFFAOYSA-N
MW384.31 g/mol
LogP3.45
Rot. Bonds5

About N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride

N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride (PubChem CID 119460334) has the molecular formula C18H23Cl2N3O2 and a molecular weight of 384.31 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride
PubChem CID119460334
Molecular FormulaC18H23Cl2N3O2
Molecular Weight384.31 g/mol
Exact Mass383.12
IUPAC NameN-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride
SMILESCl.Cl.O=C(NCC1CCCNC1)c1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C18H21N3O2.2ClH/c22-18(21-12-14-3-1-9-19-11-14)15-5-7-16(8-6-15)23-17-4-2-10-20-13-17;;/h2,4-8,10,13-14,19H,1,3,9,11-12H2,(H,21,22);2*1H
InChIKeyOKMZPINFIWXBFH-UHFFFAOYSA-N
XLogP3.45
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.31
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride 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

N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
4-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462898
N-(piperidin-3-ylmethyl)-4-pyrazol-1-ylbenzamide
CID 119461275
4-(phenylcarbamoylamino)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462020
4-pentoxy-N-(piperidin-3-ylmethyl)benzamide
CID 119463502
N-(piperidin-3-ylmethyl)quinoline-6-carboxamide
CID 62874382
4-(oxolan-2-ylmethoxy)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461774
N-(piperidin-3-ylmethyl)-4-(trifluoromethyl)benzamide
CID 24701631
N-(piperidin-3-ylmethyl)-2-pyridin-3-ylpropanamide;dihydrochloride
CID 119460803
4-N,4-N-diethyl-1-N-(piperidin-3-ylmethyl)benzene-1,4-dicarboxamide;hydrochloride
CID 119463375
4-(dimethylamino)-N-(piperidin-3-ylmethyl)benzamide
CID 43329219
N-(cyclopropylmethyl)-4-piperidin-3-ylbenzamide;hydrochloride
CID 172654364

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride?
The IUPAC name of N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride (CID 119460334) is N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride.
What is the SMILES notation for N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride?
The canonical SMILES for N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride is Cl.Cl.O=C(NCC1CCCNC1)c1ccc(Oc2cccnc2)cc1.
What is the InChIKey of N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride?
The InChIKey is OKMZPINFIWXBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2.2ClH/c22-18(21-12-14-3-1-9-19-11-14)15-5-7-16(8-6-15)23-17-4-2-10-20-13-17;;/h2,4-8,10,13-14,19H,1,3,9,11-12H2,(H,21,22);2*1H.
What are the key properties of N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride?
N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride has a molecular weight of 384.31 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)-4-pyridin-3-yloxybenzamide;dihydrochloride is sourced from PubChem (CID 119460334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).