1-ethyl-2-methylpyrrolidine-2,3-diamine

C7H17N3 — CID 68953775

IUPAC1-ethyl-2-methylpyrrolidine-2,3-diamine
SMILESCCN1CCC(N)C1(C)N
InChIInChI=1S/C7H17N3/c1-3-10-5-4-6(8)7(10,2)9/h6H,3-5,8-9H2,1-2H3
InChIKeyAGGYMPBOPHEJQU-UHFFFAOYSA-N
MW143.23 g/mol
LogP-0.29
Rot. Bonds1

About 1-ethyl-2-methylpyrrolidine-2,3-diamine

1-ethyl-2-methylpyrrolidine-2,3-diamine (PubChem CID 68953775) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol. Its IUPAC name is 1-ethyl-2-methylpyrrolidine-2,3-diamine.

Molecular Properties

Compound Name1-ethyl-2-methylpyrrolidine-2,3-diamine
PubChem CID68953775
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC Name1-ethyl-2-methylpyrrolidine-2,3-diamine
SMILESCCN1CCC(N)C1(C)N
InChIInChI=1S/C7H17N3/c1-3-10-5-4-6(8)7(10,2)9/h6H,3-5,8-9H2,1-2H3
InChIKeyAGGYMPBOPHEJQU-UHFFFAOYSA-N
XLogP-0.29
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethyl-2,2-dimethylpyrrolidin-3-yl)acetonitrile
CID 117017458
1,2,3,3-tetramethylpiperidine-2,4-diamine
CID 175486169
1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine
CID 165444888
1-ethyl-2,2-dimethylpiperazine;dihydrochloride
CID 53398810
2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine
CID 117016985
2,2,3,3-tetramethyl-1-pentoxypiperidin-4-amine
CID 175412176
1-ethyl-2,2,5,5-tetramethylpiperazine
CID 64838947
1-(1-ethylazepan-4-yl)-3,3-dimethylpiperidin-4-amine
CID 114267616
1-[2-(dimethylamino)ethyl]-2,2-dimethylpiperidin-4-amine
CID 117020090
1-methylcyclopropane-1,2-diamine
CID 15182447
trans-(1R,2S)-1-methylcyclobutane-1,2-diamine
CID 12699189
(Z)-1-N-(1-ethyl-2,2-dimethylpiperidin-4-yl)prop-1-ene-1,2-diamine
CID 145229884

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methylpyrrolidine-2,3-diamine?
The IUPAC name of 1-ethyl-2-methylpyrrolidine-2,3-diamine (CID 68953775) is 1-ethyl-2-methylpyrrolidine-2,3-diamine.
What is the SMILES notation for 1-ethyl-2-methylpyrrolidine-2,3-diamine?
The canonical SMILES for 1-ethyl-2-methylpyrrolidine-2,3-diamine is CCN1CCC(N)C1(C)N.
What is the InChIKey of 1-ethyl-2-methylpyrrolidine-2,3-diamine?
The InChIKey is AGGYMPBOPHEJQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3/c1-3-10-5-4-6(8)7(10,2)9/h6H,3-5,8-9H2,1-2H3.
What are the key properties of 1-ethyl-2-methylpyrrolidine-2,3-diamine?
1-ethyl-2-methylpyrrolidine-2,3-diamine has a molecular weight of 143.23 g/mol, XLogP of -0.29, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methylpyrrolidine-2,3-diamine is sourced from PubChem (CID 68953775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).