6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride

C19H27ClN2O3 — CID 119824120

IUPAC6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride
SMILESCCCN(C(=O)C1=Cc2cc(OC)ccc2OC1)C1CCNCC1.Cl
InChIInChI=1S/C19H26N2O3.ClH/c1-3-10-21(16-6-8-20-9-7-16)19(22)15-11-14-12-17(23-2)4-5-18(14)24-13-15;/h4-5,11-12,16,20H,3,6-10,13H2,1-2H3;1H
InChIKeyYHVUYEXWZNMIAT-UHFFFAOYSA-N
MW366.89 g/mol
LogP2.88
Rot. Bonds5

About 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride

6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride (PubChem CID 119824120) has the molecular formula C19H27ClN2O3 and a molecular weight of 366.89 g/mol. Its IUPAC name is 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride
PubChem CID119824120
Molecular FormulaC19H27ClN2O3
Molecular Weight366.89 g/mol
Exact Mass366.17
IUPAC Name6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride
SMILESCCCN(C(=O)C1=Cc2cc(OC)ccc2OC1)C1CCNCC1.Cl
InChIInChI=1S/C19H26N2O3.ClH/c1-3-10-21(16-6-8-20-9-7-16)19(22)15-11-14-12-17(23-2)4-5-18(14)24-13-15;/h4-5,11-12,16,20H,3,6-10,13H2,1-2H3;1H
InChIKeyYHVUYEXWZNMIAT-UHFFFAOYSA-N
XLogP2.88
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.89
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-5-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119529988
6-methoxy-N-(piperidin-3-ylmethyl)-2H-chromene-3-carboxamide;hydrochloride
CID 119461393
2-fluoro-4-(4-methoxyphenyl)-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119825125
6-methoxy-N-(2-piperazin-1-ylethyl)-2H-chromene-3-carboxamide;hydrochloride
CID 119446270
3-methoxy-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823113
2-bromo-5-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 63300965
3-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119533031
N-[(2R)-2-(ethylamino)propyl]-6-methoxy-2H-chromene-3-carboxamide
CID 120654267
3,5-dimethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824323
2,3-dimethoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119826026
5-(methoxymethyl)-N-piperidin-4-yl-N-propyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 119824672
6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide
CID 120574761

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride?
The IUPAC name of 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride (CID 119824120) is 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride.
What is the SMILES notation for 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride?
The canonical SMILES for 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride is CCCN(C(=O)C1=Cc2cc(OC)ccc2OC1)C1CCNCC1.Cl.
What is the InChIKey of 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride?
The InChIKey is YHVUYEXWZNMIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3.ClH/c1-3-10-21(16-6-8-20-9-7-16)19(22)15-11-14-12-17(23-2)4-5-18(14)24-13-15;/h4-5,11-12,16,20H,3,6-10,13H2,1-2H3;1H.
What are the key properties of 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride?
6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride has a molecular weight of 366.89 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-piperidin-4-yl-N-propyl-2H-chromene-3-carboxamide;hydrochloride is sourced from PubChem (CID 119824120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).