N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride

C15H30Cl2N4O2 — CID 154908534

IUPACN-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride
SMILESCN1CCN([C@H]2COC[C@@H]2NC(=O)C2CCNCC2)CC1.Cl.Cl
InChIInChI=1S/C15H28N4O2.2ClH/c1-18-6-8-19(9-7-18)14-11-21-10-13(14)17-15(20)12-2-4-16-5-3-12;;/h12-14,16H,2-11H2,1H3,(H,17,20);2*1H/t13-,14-;;/m0../s1
InChIKeyPHRMYLLFROJKRK-AXEKQOJOSA-N
MW369.34 g/mol
LogP-0.04
Rot. Bonds3

About N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride

N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride (PubChem CID 154908534) has the molecular formula C15H30Cl2N4O2 and a molecular weight of 369.34 g/mol. Its IUPAC name is N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride
PubChem CID154908534
Molecular FormulaC15H30Cl2N4O2
Molecular Weight369.34 g/mol
Exact Mass368.17
IUPAC NameN-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride
SMILESCN1CCN([C@H]2COC[C@@H]2NC(=O)C2CCNCC2)CC1.Cl.Cl
InChIInChI=1S/C15H28N4O2.2ClH/c1-18-6-8-19(9-7-18)14-11-21-10-13(14)17-15(20)12-2-4-16-5-3-12;;/h12-14,16H,2-11H2,1H3,(H,17,20);2*1H/t13-,14-;;/m0../s1
InChIKeyPHRMYLLFROJKRK-AXEKQOJOSA-N
XLogP-0.04
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.34
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride with MolForge

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Related Compounds

N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]piperidine-4-carboxamide
CID 122557604
2-piperidin-4-yl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]acetamide;dihydrochloride
CID 154909567
N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
CID 131920628
N-(4-methyloxolan-3-yl)pyrrolidine-3-carboxamide
CID 164659164
3-ethoxy-N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]propanamide
CID 122565060
N-[(3R,4S)-4-hydroxyoxolan-3-yl]pyrrolidine-3-carboxamide
CID 130688496
N-(1-methylpyrrolidin-3-yl)piperidine-4-carboxamide
CID 61465348
ethane;(4-methylpiperazin-1-yl)-piperidin-4-ylmethanone
CID 176554643
N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride
CID 172899475
N-(2-butylcyclopentyl)piperidine-4-carboxamide;hydrochloride
CID 119316653
1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride
CID 120576315
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride?
The IUPAC name of N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride (CID 154908534) is N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride?
The canonical SMILES for N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride is CN1CCN([C@H]2COC[C@@H]2NC(=O)C2CCNCC2)CC1.Cl.Cl.
What is the InChIKey of N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride?
The InChIKey is PHRMYLLFROJKRK-AXEKQOJOSA-N. The full InChI is InChI=1S/C15H28N4O2.2ClH/c1-18-6-8-19(9-7-18)14-11-21-10-13(14)17-15(20)12-2-4-16-5-3-12;;/h12-14,16H,2-11H2,1H3,(H,17,20);2*1H/t13-,14-;;/m0../s1.
What are the key properties of N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride?
N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride has a molecular weight of 369.34 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]piperidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 154908534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).