N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide

C14H22N4O — CID 109203811

IUPACN-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc(N2CCCC2)ccn1
InChIInChI=1S/C14H22N4O/c1-17(2)10-7-16-14(19)13-11-12(5-6-15-13)18-8-3-4-9-18/h5-6,11H,3-4,7-10H2,1-2H3,(H,16,19)
InChIKeyMXONNPGJPJGHHL-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.97
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide

N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide (PubChem CID 109203811) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide
PubChem CID109203811
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc(N2CCCC2)ccn1
InChIInChI=1S/C14H22N4O/c1-17(2)10-7-16-14(19)13-11-12(5-6-15-13)18-8-3-4-9-18/h5-6,11H,3-4,7-10H2,1-2H3,(H,16,19)
InChIKeyMXONNPGJPJGHHL-UHFFFAOYSA-N
XLogP0.97
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-4-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 109207121
4-N-[2-(dimethylamino)ethyl]-2-N-(4-pyrrolidin-1-ylphenyl)pyridine-2,4-dicarboxamide
CID 109083518
4-(azepane-1-carbonyl)-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 109083611
4-(azepan-1-yl)-N-pentylpyridine-2-carboxamide
CID 109217503
N-(3-methoxypropyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204551
N-[2-(dimethylamino)ethyl]-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyridine-2-carboxamide
CID 109207136
N-[3-(dimethylamino)propyl]-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridine-2-carboxamide
CID 109207757
N-[2-(dimethylamino)ethyl]-6-(4-pyrrolidin-1-ylanilino)pyrimidine-4-carboxamide
CID 109344367
4-amino-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 62154340
N-[2-(dimethylamino)ethyl]-5-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxamide
CID 109185416
N-(3-phenylpropyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204611
4-(azepane-1-carbonyl)-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109084053

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide (CID 109203811) is N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide is CN(C)CCNC(=O)c1cc(N2CCCC2)ccn1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide?
The InChIKey is MXONNPGJPJGHHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-17(2)10-7-16-14(19)13-11-12(5-6-15-13)18-8-3-4-9-18/h5-6,11H,3-4,7-10H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide?
N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 0.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 109203811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).