4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide

C10H21N3O2 — CID 106813309

IUPAC4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
SMILESCNC(=O)CCN(C)C(=O)CCC(C)N
InChIInChI=1S/C10H21N3O2/c1-8(11)4-5-10(15)13(3)7-6-9(14)12-2/h8H,4-7,11H2,1-3H3,(H,12,14)
InChIKeyMECZVJYGURNFTC-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.29
Rot. Bonds6

About 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide

4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide (PubChem CID 106813309) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
PubChem CID106813309
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
SMILESCNC(=O)CCN(C)C(=O)CCC(C)N
InChIInChI=1S/C10H21N3O2/c1-8(11)4-5-10(15)13(3)7-6-9(14)12-2/h8H,4-7,11H2,1-3H3,(H,12,14)
InChIKeyMECZVJYGURNFTC-UHFFFAOYSA-N
XLogP-0.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-methylsulfonylbutanamide
CID 103827599
2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 103810328
2-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]hexanamide
CID 103832738
2,3-dimethyl-4-[methyl-[3-(methylamino)-3-oxopropyl]amino]-4-oxobutanoic acid
CID 106914932
3-(3-aminobutylsulfonyl)-N-methylpropanamide
CID 81193833
3-(4-aminocyclohexyl)-N-methyl-N-[3-(methylamino)-3-oxopropyl]propanamide
CID 106918215
3-[2-hydroxypropyl(propan-2-yl)amino]-N-methylpropanamide
CID 111107973
5-amino-N-[2-(dimethylamino)ethyl]-N-methylhexanamide
CID 82852143
2-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pent-4-enamide
CID 106915272
4-amino-N,5-dimethylhexanamide
CID 102537827
2-hydroxyethyl N-methyl-N-[3-(methylamino)-3-oxopropyl]carbamate
CID 106918325
4-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]pentanamide
CID 115156830

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
The IUPAC name of 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide (CID 106813309) is 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide.
What is the SMILES notation for 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
The canonical SMILES for 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide is CNC(=O)CCN(C)C(=O)CCC(C)N.
What is the InChIKey of 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
The InChIKey is MECZVJYGURNFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-8(11)4-5-10(15)13(3)7-6-9(14)12-2/h8H,4-7,11H2,1-3H3,(H,12,14).
What are the key properties of 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide has a molecular weight of 215.30 g/mol, XLogP of -0.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide is sourced from PubChem (CID 106813309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).