4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide

C16H28N4O — CID 66430451

IUPAC4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide
SMILESCCN(CC)C(=O)CC(CN)N(C)CCc1ccccn1
InChIInChI=1S/C16H28N4O/c1-4-20(5-2)16(21)12-15(13-17)19(3)11-9-14-8-6-7-10-18-14/h6-8,10,15H,4-5,9,11-13,17H2,1-3H3
InChIKeyPHDKMQFNYRMXMV-UHFFFAOYSA-N
MW292.43 g/mol
LogP1.14
Rot. Bonds9

About 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide

4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide (PubChem CID 66430451) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide
PubChem CID66430451
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide
SMILESCCN(CC)C(=O)CC(CN)N(C)CCc1ccccn1
InChIInChI=1S/C16H28N4O/c1-4-20(5-2)16(21)12-15(13-17)19(3)11-9-14-8-6-7-10-18-14/h6-8,10,15H,4-5,9,11-13,17H2,1-3H3
InChIKeyPHDKMQFNYRMXMV-UHFFFAOYSA-N
XLogP1.14
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
CID 66427540
3-[methyl(2-pyridin-2-ylethyl)amino]butanethioamide
CID 60915227
3-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pentane-1,2-diamine
CID 43187234
3-[methyl(2-pyridin-2-ylethyl)amino]-3-phenylpropanoic acid
CID 63069614
2-[methyl(2-pyridin-2-ylethyl)amino]pentyl 2-amino-3-methylbutanoate
CID 178172677
2-[methyl(2-pyridin-2-ylethyl)amino]-1-phenylpropan-1-one
CID 43228048
4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide
CID 66430158
3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide
CID 39241658
ethane;N-methyl-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 142585406
2-[methyl(2-pyridin-2-ylethyl)amino]-2-phenylacetohydrazide
CID 63572687
1-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-N-(2-pyridin-2-ylethyl)ethane-1,2-diamine
CID 115989833
2-N-methyl-1-N-(2-methylpropyl)-2-N-(2-pyridin-2-ylethyl)propane-1,2-diamine
CID 62417470

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide?
The IUPAC name of 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide (CID 66430451) is 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide.
What is the SMILES notation for 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide?
The canonical SMILES for 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide is CCN(CC)C(=O)CC(CN)N(C)CCc1ccccn1.
What is the InChIKey of 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide?
The InChIKey is PHDKMQFNYRMXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-4-20(5-2)16(21)12-15(13-17)19(3)11-9-14-8-6-7-10-18-14/h6-8,10,15H,4-5,9,11-13,17H2,1-3H3.
What are the key properties of 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide?
4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide has a molecular weight of 292.43 g/mol, XLogP of 1.14, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide is sourced from PubChem (CID 66430451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).