N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine

C14H28N2 — CID 63859137

IUPACN-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine
SMILESCCCC1(CN(C)CC2CC2C)CCNC1
InChIInChI=1S/C14H28N2/c1-4-5-14(6-7-15-10-14)11-16(3)9-13-8-12(13)2/h12-13,15H,4-11H2,1-3H3
InChIKeyIXCNGACJHDBHBJ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.35
Rot. Bonds6

About N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine

N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine (PubChem CID 63859137) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine
PubChem CID63859137
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine
SMILESCCCC1(CN(C)CC2CC2C)CCNC1
InChIInChI=1S/C14H28N2/c1-4-5-14(6-7-15-10-14)11-16(3)9-13-8-12(13)2/h12-13,15H,4-11H2,1-3H3
InChIKeyIXCNGACJHDBHBJ-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine?
The IUPAC name of N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine (CID 63859137) is N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine.
What is the SMILES notation for N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine?
The canonical SMILES for N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine is CCCC1(CN(C)CC2CC2C)CCNC1.
What is the InChIKey of N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine?
The InChIKey is IXCNGACJHDBHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-5-14(6-7-15-10-14)11-16(3)9-13-8-12(13)2/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine?
N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine has a molecular weight of 224.39 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylcyclopropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]methanamine is sourced from PubChem (CID 63859137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).