N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide

C16H26N4O — CID 53185944

IUPACN-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
SMILESCN(C)CCNC(=O)CCc1ccnc(N2CCCC2)c1
InChIInChI=1S/C16H26N4O/c1-19(2)12-9-18-16(21)6-5-14-7-8-17-15(13-14)20-10-3-4-11-20/h7-8,13H,3-6,9-12H2,1-2H3,(H,18,21)
InChIKeyBZEFPOMRQKXNMV-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.29
Rot. Bonds7

About N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide

N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide (PubChem CID 53185944) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
PubChem CID53185944
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
SMILESCN(C)CCNC(=O)CCc1ccnc(N2CCCC2)c1
InChIInChI=1S/C16H26N4O/c1-19(2)12-9-18-16(21)6-5-14-7-8-17-15(13-14)20-10-3-4-11-20/h7-8,13H,3-6,9-12H2,1-2H3,(H,18,21)
InChIKeyBZEFPOMRQKXNMV-UHFFFAOYSA-N
XLogP1.29
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273482
N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185930
3-(2-pyrrolidin-1-yl-4-pyridinyl)-N-(2-thiophen-2-ylethyl)propanamide
CID 53185937
N-pentan-3-yl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273250
3-(2-pyrrolidin-1-yl-4-pyridinyl)propanoic acid
CID 82661762
N-[(2-methoxyphenyl)methyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185909
1-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-3-[2-[ethyl(methyl)amino]ethyl]urea
CID 86899195
3-amino-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propanamide
CID 119841583
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186075
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propanamide
CID 86945172
3-(3-amino-4-pyrrolidin-1-ylphenyl)-N-[4-(dimethylamino)butyl]propanamide
CID 39112746
N-[2-(dimethylamino)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203811

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide (CID 53185944) is N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide is CN(C)CCNC(=O)CCc1ccnc(N2CCCC2)c1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The InChIKey is BZEFPOMRQKXNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-19(2)12-9-18-16(21)6-5-14-7-8-17-15(13-14)20-10-3-4-11-20/h7-8,13H,3-6,9-12H2,1-2H3,(H,18,21).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide is sourced from PubChem (CID 53185944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).