N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine

C9H18N2 — CID 143197618

IUPACN,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine
SMILESCC1=CCCN1CCN(C)C
InChIInChI=1S/C9H18N2/c1-9-5-4-6-11(9)8-7-10(2)3/h5H,4,6-8H2,1-3H3
InChIKeyNQSJWQZNHQUVKB-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.16
Rot. Bonds3

About N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine

N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine (PubChem CID 143197618) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine
PubChem CID143197618
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC NameN,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine
SMILESCC1=CCCN1CCN(C)C
InChIInChI=1S/C9H18N2/c1-9-5-4-6-11(9)8-7-10(2)3/h5H,4,6-8H2,1-3H3
InChIKeyNQSJWQZNHQUVKB-UHFFFAOYSA-N
XLogP1.16
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Pyrroline, 1,2-dimethyl-
CID 565081
(E)-1-Pyrrolidino-2-pentene
CID 5462837
1-Ethyl-2-methyl-2-pyrrolin
CID 12411602
1-(1-Ethylpropenyl)pyrrolidine
CID 139574
1-Methyl-4-dimethylamino-1,2,5,6-tetrahydropyridine
CID 12664027
1-[(1Z)-1-Ethyl-1-propenyl]pyrrolidine
CID 5371408
1-methyl-N,N-dipropyl-3,6-dihydro-2H-pyridin-4-amine
CID 134830533
1,5-Diethyl-2,3-dihydropyrrole
CID 12411603
(E)-N,N-diethylpent-2-en-3-amine
CID 12664029
5-Ethyl-1-methyl-2,3-dihydropyrrole
CID 13694312
1-[(E)-hex-3-en-3-yl]pyrrolidine
CID 13700166
1-Ethyl-4-dimethylamino-1,2,5,6-tetrahydropyridine
CID 15068656

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine (CID 143197618) is N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine is CC1=CCCN1CCN(C)C.
What is the InChIKey of N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine?
The InChIKey is NQSJWQZNHQUVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-9-5-4-6-11(9)8-7-10(2)3/h5H,4,6-8H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine?
N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine has a molecular weight of 154.26 g/mol, XLogP of 1.16, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine is sourced from PubChem (CID 143197618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).