N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide

C15H32N4O — CID 63172162

IUPACN-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide
SMILESCCN(CC)C1CCN(CCC(=O)N(C)CCCN)C1
InChIInChI=1S/C15H32N4O/c1-4-19(5-2)14-7-11-18(13-14)12-8-15(20)17(3)10-6-9-16/h14H,4-13,16H2,1-3H3
InChIKeyRAGFHLHXWKBJNU-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.60
Rot. Bonds9

About N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide

N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide (PubChem CID 63172162) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide
PubChem CID63172162
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC NameN-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide
SMILESCCN(CC)C1CCN(CCC(=O)N(C)CCCN)C1
InChIInChI=1S/C15H32N4O/c1-4-19(5-2)14-7-11-18(13-14)12-8-15(20)17(3)10-6-9-16/h14H,4-13,16H2,1-3H3
InChIKeyRAGFHLHXWKBJNU-UHFFFAOYSA-N
XLogP0.60
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-aminopropyl)-N-methyl-3-(6-oxo-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-2-yl)propanamide
CID 82855691
N-(3-aminopropyl)-3-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-N-methylpropanamide
CID 62884866
1-[3-[3-aminopropyl(methyl)amino]-3-oxopropyl]-N-methylpiperidine-3-carboxamide
CID 103194926
3-[3-(diethylamino)pyrrolidin-1-yl]propanethioamide
CID 63169620
N-(3-aminopropyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)-N-methylpropanamide
CID 43581216
3-[3-(diethylamino)piperidin-1-yl]propanoic acid
CID 83840059
3-[3-(diethylamino)pyrrolidin-1-yl]propan-1-ol
CID 63164582
1-(4-chlorophenyl)-3-[3-(diethylamino)pyrrolidin-1-yl]propan-1-one
CID 63165624
1-(4-aminobutyl)-N,N-dimethylpyrrolidin-3-amine
CID 63166062
6-amino-1-[3-(diethylamino)pyrrolidin-1-yl]hexan-1-one
CID 55157992
N-(3-aminopropyl)-3-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpropanamide
CID 83228224
2-amino-5-[3-(diethylamino)pyrrolidin-1-yl]-2-methylpentanamide
CID 63165258

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide?
The IUPAC name of N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide (CID 63172162) is N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide.
What is the SMILES notation for N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide?
The canonical SMILES for N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide is CCN(CC)C1CCN(CCC(=O)N(C)CCCN)C1.
What is the InChIKey of N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide?
The InChIKey is RAGFHLHXWKBJNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-4-19(5-2)14-7-11-18(13-14)12-8-15(20)17(3)10-6-9-16/h14H,4-13,16H2,1-3H3.
What are the key properties of N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide?
N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide has a molecular weight of 284.45 g/mol, XLogP of 0.60, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-3-[3-(diethylamino)pyrrolidin-1-yl]-N-methylpropanamide is sourced from PubChem (CID 63172162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).