4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide

C14H24N4O — CID 66430158

IUPAC4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide
SMILESCC(C)NC(=O)CC(CN)N(C)Cc1ccccn1
InChIInChI=1S/C14H24N4O/c1-11(2)17-14(19)8-13(9-15)18(3)10-12-6-4-5-7-16-12/h4-7,11,13H,8-10,15H2,1-3H3,(H,17,19)
InChIKeyOGBIQFJSIDVWRO-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.76
Rot. Bonds7

About 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide

4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide (PubChem CID 66430158) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide.

Molecular Properties

Compound Name4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide
PubChem CID66430158
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide
SMILESCC(C)NC(=O)CC(CN)N(C)Cc1ccccn1
InChIInChI=1S/C14H24N4O/c1-11(2)17-14(19)8-13(9-15)18(3)10-12-6-4-5-7-16-12/h4-7,11,13H,8-10,15H2,1-3H3,(H,17,19)
InChIKeyOGBIQFJSIDVWRO-UHFFFAOYSA-N
XLogP0.76
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
CID 66427540
4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
CID 66431406
4-[methyl(pyridin-2-ylmethyl)amino]pentanehydrazide
CID 63572365
4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide
CID 66430451
3-N-methyl-3-N-(pyridin-2-ylmethyl)butane-1,3-diamine
CID 60914164
3-[methyl(pyridin-2-ylmethyl)amino]butanethioamide
CID 60914342
3,3,3-trifluoro-2-N-methyl-2-N-(pyridin-2-ylmethyl)propane-1,2-diamine
CID 43752727
3-methyl-1-[methyl(pyridin-2-ylmethyl)amino]butan-2-one
CID 79396474
(2S)-2-[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]propanoic acid
CID 78967862
methyl 2-methyl-3-[methyl(pyridin-2-ylmethyl)amino]propanoate
CID 43565155
ethyl 3-[methyl(pyridin-2-ylmethyl)amino]-3-oxopropanoate
CID 115138599
1-(4-chlorophenyl)-N-methyl-N-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 43564825

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide?
The IUPAC name of 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide (CID 66430158) is 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide.
What is the SMILES notation for 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide?
The canonical SMILES for 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide is CC(C)NC(=O)CC(CN)N(C)Cc1ccccn1.
What is the InChIKey of 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide?
The InChIKey is OGBIQFJSIDVWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11(2)17-14(19)8-13(9-15)18(3)10-12-6-4-5-7-16-12/h4-7,11,13H,8-10,15H2,1-3H3,(H,17,19).
What are the key properties of 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide?
4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide has a molecular weight of 264.37 g/mol, XLogP of 0.76, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide is sourced from PubChem (CID 66430158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).