N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride

C19H29ClN2O — CID 119825779

IUPACN-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride
SMILESCCCN(C(=O)C1CCCc2ccccc21)C1CCNCC1.Cl
InChIInChI=1S/C19H28N2O.ClH/c1-2-14-21(16-10-12-20-13-11-16)19(22)18-9-5-7-15-6-3-4-8-17(15)18;/h3-4,6,8,16,18,20H,2,5,7,9-14H2,1H3;1H
InChIKeyZPTZQADIMBPPAK-UHFFFAOYSA-N
MW336.91 g/mol
LogP3.52
Rot. Bonds4

About N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride

N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride (PubChem CID 119825779) has the molecular formula C19H29ClN2O and a molecular weight of 336.91 g/mol. Its IUPAC name is N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride
PubChem CID119825779
Molecular FormulaC19H29ClN2O
Molecular Weight336.91 g/mol
Exact Mass336.20
IUPAC NameN-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride
SMILESCCCN(C(=O)C1CCCc2ccccc21)C1CCNCC1.Cl
InChIInChI=1S/C19H28N2O.ClH/c1-2-14-21(16-10-12-20-13-11-16)19(22)18-9-5-7-15-6-3-4-8-17(15)18;/h3-4,6,8,16,18,20H,2,5,7,9-14H2,1H3;1H
InChIKeyZPTZQADIMBPPAK-UHFFFAOYSA-N
XLogP3.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.91
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride?
The IUPAC name of N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride (CID 119825779) is N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride.
What is the SMILES notation for N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride?
The canonical SMILES for N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride is CCCN(C(=O)C1CCCc2ccccc21)C1CCNCC1.Cl.
What is the InChIKey of N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride?
The InChIKey is ZPTZQADIMBPPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O.ClH/c1-2-14-21(16-10-12-20-13-11-16)19(22)18-9-5-7-15-6-3-4-8-17(15)18;/h3-4,6,8,16,18,20H,2,5,7,9-14H2,1H3;1H.
What are the key properties of N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride?
N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride has a molecular weight of 336.91 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;hydrochloride is sourced from PubChem (CID 119825779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).