N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine

C6H12N2 — CID 22598257

IUPACN,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine
SMILESCN(C)C1=CNCC1
InChIInChI=1S/C6H12N2/c1-8(2)6-3-4-7-5-6/h5,7H,3-4H2,1-2H3
InChIKeyIZMVOKRXIMKUOB-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.38
Rot. Bonds1

About N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine

N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine (PubChem CID 22598257) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine
PubChem CID22598257
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC NameN,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine
SMILESCN(C)C1=CNCC1
InChIInChI=1S/C6H12N2/c1-8(2)6-3-4-7-5-6/h5,7H,3-4H2,1-2H3
InChIKeyIZMVOKRXIMKUOB-UHFFFAOYSA-N
XLogP0.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-methyl-2,3-dihydro-1H-imidazol-5-yl)ethanamine
CID 44267952
3,4-Diamino-pyrroline
CID 129691641
1-(3-Fluoropropyl)-2,3-dihydropyrrol-4-amine
CID 164561324
1,2-Dimethylamino-3-methyl-1-butene
CID 129810630
2,3-dihydro-1H-pyrrol-4-amine
CID 19101435
3-amino-N-methyl pyrroline
CID 19820661
3-ethyl-4-methyl-1H-pyrazine
CID 20239888
4-ethyl-2,3-dihydro-1H-imidazole
CID 53631548
2-(2,3-dihydro-1H-imidazol-4-yl)ethanamine
CID 55284141
1,4-Dihydropyridine-3,5-diamine
CID 56972715
(Z)-1-N,2-N,4-N-trimethylbut-1-ene-1,2,4-triamine
CID 59950669
6-ethyl-4-methyl-2,3-dihydro-1H-pyrazine
CID 68888461

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine?
The IUPAC name of N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine (CID 22598257) is N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine.
What is the SMILES notation for N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine?
The canonical SMILES for N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine is CN(C)C1=CNCC1.
What is the InChIKey of N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine?
The InChIKey is IZMVOKRXIMKUOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-8(2)6-3-4-7-5-6/h5,7H,3-4H2,1-2H3.
What are the key properties of N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine?
N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine has a molecular weight of 112.18 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,3-dihydro-1H-pyrrol-4-amine is sourced from PubChem (CID 22598257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).