3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide

C14H24N4O — CID 60849579

IUPAC3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide
SMILESCN(C)c1ncccc1NC(=O)CCNC(C)(C)C
InChIInChI=1S/C14H24N4O/c1-14(2,3)16-10-8-12(19)17-11-7-6-9-15-13(11)18(4)5/h6-7,9,16H,8,10H2,1-5H3,(H,17,19)
InChIKeyQRLGJJAWIAZCGA-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.86
Rot. Bonds5

About 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide

3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide (PubChem CID 60849579) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide
PubChem CID60849579
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide
SMILESCN(C)c1ncccc1NC(=O)CCNC(C)(C)C
InChIInChI=1S/C14H24N4O/c1-14(2,3)16-10-8-12(19)17-11-7-6-9-15-13(11)18(4)5/h6-7,9,16H,8,10H2,1-5H3,(H,17,19)
InChIKeyQRLGJJAWIAZCGA-UHFFFAOYSA-N
XLogP1.86
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[2-(dimethylamino)-3-pyridinyl]butanamide
CID 63308102
N-[2-(dimethylamino)-3-pyridinyl]-5-hydroxypentanamide
CID 79199831
3-[[2-(dimethylamino)-3-pyridinyl]amino]-3-oxopropanoic acid
CID 62230948
6-amino-N-[2-(dimethylamino)-3-pyridinyl]hexanamide
CID 43706742
3-chloro-N-[2-(dimethylamino)-3-pyridinyl]-2,2-dimethylpropanamide
CID 63680361
2-[2-[[2-(dimethylamino)-3-pyridinyl]amino]-2-oxoethyl]sulfanylacetic acid
CID 104569324
N-[2-(dimethylamino)-3-pyridinyl]-2-ethoxyacetamide
CID 60778535
N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide
CID 60850191
2-N,2-N-dimethyl-3-N-propylpyridine-2,3-diamine
CID 43707989
(2S)-2-amino-N-[2-[[2-(dimethylamino)-3-pyridinyl]amino]-2-oxoethyl]-3-methylbutanamide
CID 82963467
1-[2-(dimethylamino)-3-pyridinyl]-3-(2-fluorophenyl)urea
CID 53016555
4-(chloromethyl)-N-[2-(dimethylamino)-3-pyridinyl]benzamide
CID 43698922

Frequently Asked Questions

What is the IUPAC name of 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide?
The IUPAC name of 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide (CID 60849579) is 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide.
What is the SMILES notation for 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide?
The canonical SMILES for 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide is CN(C)c1ncccc1NC(=O)CCNC(C)(C)C.
What is the InChIKey of 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide?
The InChIKey is QRLGJJAWIAZCGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-14(2,3)16-10-8-12(19)17-11-7-6-9-15-13(11)18(4)5/h6-7,9,16H,8,10H2,1-5H3,(H,17,19).
What are the key properties of 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide?
3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide has a molecular weight of 264.37 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide is sourced from PubChem (CID 60849579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).