N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine

C8H16N2 — CID 137451585

IUPACN-[(2-methylpyrrolidin-1-yl)methyl]ethenamine
SMILESC=CNCN1CCCC1C
InChIInChI=1S/C8H16N2/c1-3-9-7-10-6-4-5-8(10)2/h3,8-9H,1,4-7H2,2H3
InChIKeyJGFYVZAGUQNUNI-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.16
Rot. Bonds3

About N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine

N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine (PubChem CID 137451585) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine.

Molecular Properties

Compound NameN-[(2-methylpyrrolidin-1-yl)methyl]ethenamine
PubChem CID137451585
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-[(2-methylpyrrolidin-1-yl)methyl]ethenamine
SMILESC=CNCN1CCCC1C
InChIInChI=1S/C8H16N2/c1-3-9-7-10-6-4-5-8(10)2/h3,8-9H,1,4-7H2,2H3
InChIKeyJGFYVZAGUQNUNI-UHFFFAOYSA-N
XLogP1.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 71361025
CID 71361025
CID 21479082
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CID 21479128
CID 21479128
CID 53847391
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CID 57064827
CID 57064827
CID 57376742
CID 57376742
CID 57828710
CID 57828710
CID 67523317
CID 67523317
CID 69388379
CID 69388379
CID 69391074
CID 69391074
CID 69392969
CID 69392969
CID 69393651
CID 69393651

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine?
The IUPAC name of N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine (CID 137451585) is N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine.
What is the SMILES notation for N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine?
The canonical SMILES for N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine is C=CNCN1CCCC1C.
What is the InChIKey of N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine?
The InChIKey is JGFYVZAGUQNUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-9-7-10-6-4-5-8(10)2/h3,8-9H,1,4-7H2,2H3.
What are the key properties of N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine?
N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine has a molecular weight of 140.23 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrrolidin-1-yl)methyl]ethenamine is sourced from PubChem (CID 137451585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).