3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride

C12H24ClN3O — CID 120849955

IUPAC3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCC1(C(N)=O)CCN(CC2CCCNC2)C1.Cl
InChIInChI=1S/C12H23N3O.ClH/c1-12(11(13)16)4-6-15(9-12)8-10-3-2-5-14-7-10;/h10,14H,2-9H2,1H3,(H2,13,16);1H
InChIKeyCJHWNSMTIYHVLD-UHFFFAOYSA-N
MW261.80 g/mol
LogP0.61
Rot. Bonds3

About 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride

3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 120849955) has the molecular formula C12H24ClN3O and a molecular weight of 261.80 g/mol. Its IUPAC name is 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID120849955
Molecular FormulaC12H24ClN3O
Molecular Weight261.80 g/mol
Exact Mass261.16
IUPAC Name3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCC1(C(N)=O)CCN(CC2CCCNC2)C1.Cl
InChIInChI=1S/C12H23N3O.ClH/c1-12(11(13)16)4-6-15(9-12)8-10-3-2-5-14-7-10;/h10,14H,2-9H2,1H3,(H2,13,16);1H
InChIKeyCJHWNSMTIYHVLD-UHFFFAOYSA-N
XLogP0.61
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.80
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide
CID 114082034
[3-fluoro-1-(piperidin-3-ylmethyl)pyrrolidin-3-yl]methanol;hydrochloride
CID 120858328
4-fluoro-4-methyl-1-(piperidin-3-ylmethyl)piperidine
CID 115028862
(3R)-3-[(3,3-difluoropyrrolidin-1-yl)methyl]piperidine
CID 130630857
3,3-dimethyl-1-(piperidin-3-ylmethyl)piperidin-4-ol
CID 120848601
3-[(3,3-dimethylazetidin-1-yl)methyl]piperidine
CID 79678705
(3S)-3-[(3-ethyl-3-methylazetidin-1-yl)methyl]piperidine
CID 131186194
3,3-difluoro-4-methyl-1-(piperidin-3-ylmethyl)piperidine
CID 120849326
1-[[(3R)-1-[[(3S)-piperidin-3-yl]methyl]pyrrolidin-3-yl]methyl]piperidine-4-carboxamide
CID 177096923
2-(piperidin-3-ylmethyl)-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
CID 119931803
N,3-dimethyl-1-(2-piperidin-3-ylacetyl)pyrrolidine-3-carboxamide
CID 106318342
3,3,5-trimethyl-1-(piperidin-3-ylmethyl)piperidine;hydrochloride
CID 120848754

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride (CID 120849955) is 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride is CC1(C(N)=O)CCN(CC2CCCNC2)C1.Cl.
What is the InChIKey of 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is CJHWNSMTIYHVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O.ClH/c1-12(11(13)16)4-6-15(9-12)8-10-3-2-5-14-7-10;/h10,14H,2-9H2,1H3,(H2,13,16);1H.
What are the key properties of 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 261.80 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(piperidin-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 120849955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).