(2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide

C17H26N4O — CID 99854717

IUPAC(2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide
SMILESC[C@]1(C(N)=O)CCCCN1Cc1ccc(N2CCCC2)nc1
InChIInChI=1S/C17H26N4O/c1-17(16(18)22)8-2-3-11-21(17)13-14-6-7-15(19-12-14)20-9-4-5-10-20/h6-7,12H,2-5,8-11,13H2,1H3,(H2,18,22)/t17-/m1/s1
InChIKeyRYOIOIJXXPWCHB-QGZVFWFLSA-N
MW302.42 g/mol
LogP1.91
Rot. Bonds4

About (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide

(2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide (PubChem CID 99854717) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide
PubChem CID99854717
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name(2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide
SMILESC[C@]1(C(N)=O)CCCCN1Cc1ccc(N2CCCC2)nc1
InChIInChI=1S/C17H26N4O/c1-17(16(18)22)8-2-3-11-21(17)13-14-6-7-15(19-12-14)20-9-4-5-10-20/h6-7,12H,2-5,8-11,13H2,1H3,(H2,18,22)/t17-/m1/s1
InChIKeyRYOIOIJXXPWCHB-QGZVFWFLSA-N
XLogP1.91
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-hydroxy-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]cyclopentane-1-carboxamide
CID 110907185
1-(6-piperidin-1-yl-3-pyridinyl)propan-2-one
CID 83888260
methyl 1-[(6-pyrrolidin-1-yl-3-pyridinyl)methylamino]cyclopropane-1-carboxylate
CID 86805959
2-[[6-(azepan-1-yl)-3-pyridinyl]methyl]-1-tert-butylguanidine
CID 111049192
3,3-dimethyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidin-4-amine;hydrochloride
CID 120781479
2-methyl-1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide
CID 126792905
[6-(4,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 62937885
1-benzyl-2-methylpiperidine-2-carboxylate
CID 71434868
N'-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-1-carboximidamide;hydroiodide
CID 111048899
2,5-dimethyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperazine
CID 120906110
(2R)-2-amino-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]propanamide
CID 119846624
N-[[6-(azepan-1-yl)-3-pyridinyl]methyl]-2-methoxyacetamide
CID 71842546

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide (CID 99854717) is (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide is C[C@]1(C(N)=O)CCCCN1Cc1ccc(N2CCCC2)nc1.
What is the InChIKey of (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide?
The InChIKey is RYOIOIJXXPWCHB-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H26N4O/c1-17(16(18)22)8-2-3-11-21(17)13-14-6-7-15(19-12-14)20-9-4-5-10-20/h6-7,12H,2-5,8-11,13H2,1H3,(H2,18,22)/t17-/m1/s1.
What are the key properties of (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide?
(2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 99854717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).