N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide

C15H26N4O — CID 106917955

IUPACN,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide
SMILESCCCNc1cc(CN(C)CC(C)C(=O)NC)ccn1
InChIInChI=1S/C15H26N4O/c1-5-7-17-14-9-13(6-8-18-14)11-19(4)10-12(2)15(20)16-3/h6,8-9,12H,5,7,10-11H2,1-4H3,(H,16,20)(H,17,18)
InChIKeyCPDAJRXODLTAGB-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.72
Rot. Bonds8

About N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide

N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide (PubChem CID 106917955) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide
PubChem CID106917955
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide
SMILESCCCNc1cc(CN(C)CC(C)C(=O)NC)ccn1
InChIInChI=1S/C15H26N4O/c1-5-7-17-14-9-13(6-8-18-14)11-19(4)10-12(2)15(20)16-3/h6,8-9,12H,5,7,10-11H2,1-4H3,(H,16,20)(H,17,18)
InChIKeyCPDAJRXODLTAGB-UHFFFAOYSA-N
XLogP1.72
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[methyl(3-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62465932
4-[[methyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62469698
4-[[ethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62472407
N-ethyl-2-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]acetamide
CID 62465711
3-[[3-chloro-6-(propylamino)-2-pyridinyl]methyl-methylamino]-N,2-dimethylpropanamide
CID 106917976
4-[[(4-fluorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
CID 62464531
4-[[ethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62470960
2-[[2-(ethylamino)-4-pyridinyl]methyl-methylamino]-N-methylacetamide
CID 62472420
4-(diethylaminomethyl)-N-propylpyridin-2-amine
CID 62472000
3-[(6-amino-3-pyridinyl)methyl-methylamino]-N,2-dimethylpropanamide
CID 104870323
1-[[2-(ethylamino)-4-pyridinyl]methyl-methylamino]-3-methoxypropan-2-ol
CID 62464336
N,2-dimethyl-3-[methyl-[[4-methyl-6-(methylamino)pyrimidin-2-yl]methyl]amino]propanamide
CID 106917983

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide?
The IUPAC name of N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide (CID 106917955) is N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide.
What is the SMILES notation for N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide?
The canonical SMILES for N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide is CCCNc1cc(CN(C)CC(C)C(=O)NC)ccn1.
What is the InChIKey of N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide?
The InChIKey is CPDAJRXODLTAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-5-7-17-14-9-13(6-8-18-14)11-19(4)10-12(2)15(20)16-3/h6,8-9,12H,5,7,10-11H2,1-4H3,(H,16,20)(H,17,18).
What are the key properties of N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide?
N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide has a molecular weight of 278.40 g/mol, XLogP of 1.72, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[methyl-[[2-(propylamino)-4-pyridinyl]methyl]amino]propanamide is sourced from PubChem (CID 106917955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).