4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride

C15H31Cl2N3O2 — CID 119851493

IUPAC4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride
SMILESCOC1(C(=O)NC(C)CN2CCCCC2)CCNCC1.Cl.Cl
InChIInChI=1S/C15H29N3O2.2ClH/c1-13(12-18-10-4-3-5-11-18)17-14(19)15(20-2)6-8-16-9-7-15;;/h13,16H,3-12H2,1-2H3,(H,17,19);2*1H
InChIKeyMBACKZZHELJJER-UHFFFAOYSA-N
MW356.34 g/mol
LogP1.59
Rot. Bonds5

About 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride

4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride (PubChem CID 119851493) has the molecular formula C15H31Cl2N3O2 and a molecular weight of 356.34 g/mol. Its IUPAC name is 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound Name4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride
PubChem CID119851493
Molecular FormulaC15H31Cl2N3O2
Molecular Weight356.34 g/mol
Exact Mass355.18
IUPAC Name4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride
SMILESCOC1(C(=O)NC(C)CN2CCCCC2)CCNCC1.Cl.Cl
InChIInChI=1S/C15H29N3O2.2ClH/c1-13(12-18-10-4-3-5-11-18)17-14(19)15(20-2)6-8-16-9-7-15;;/h13,16H,3-12H2,1-2H3,(H,17,19);2*1H
InChIKeyMBACKZZHELJJER-UHFFFAOYSA-N
XLogP1.59
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.34
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(5-methylhexan-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119674910
3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
CID 63142239
4-methoxy-N-(4-methoxy-4-methylpentan-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119803249
4-methoxy-N-(6-methylheptan-2-yl)piperidine-4-carboxamide
CID 119673358
4-methoxy-N-(4-methoxy-4-methylpentan-2-yl)piperidine-4-carboxamide
CID 119803250
N-(1-imidazol-1-ylpropan-2-yl)-4-methoxypiperidine-4-carboxamide
CID 119856882
N-[1-(diethylamino)propan-2-yl]-4-methoxypiperidine-4-carboxamide
CID 119860570
4-methoxy-N-(5-piperidin-1-ylpentyl)piperidine-4-carboxamide
CID 119885466
4-methoxy-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide;dihydrochloride
CID 119836245
N-[3-(azepan-1-yl)-3-oxopropyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119761918
1-(aminomethyl)-N-(1-pyrrolidin-1-ylpropan-2-yl)cyclopropane-1-carboxamide
CID 80588338
4-methoxy-N-[(1-piperidin-1-ylcyclohexyl)methyl]piperidine-4-carboxamide
CID 119682329

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride?
The IUPAC name of 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride (CID 119851493) is 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride?
The canonical SMILES for 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride is COC1(C(=O)NC(C)CN2CCCCC2)CCNCC1.Cl.Cl.
What is the InChIKey of 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride?
The InChIKey is MBACKZZHELJJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2.2ClH/c1-13(12-18-10-4-3-5-11-18)17-14(19)15(20-2)6-8-16-9-7-15;;/h13,16H,3-12H2,1-2H3,(H,17,19);2*1H.
What are the key properties of 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride?
4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride has a molecular weight of 356.34 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 119851493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).