N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine

C15H31N3 — CID 63274170

IUPACN-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine
SMILESCCC1(CN(C)CC2CCN(C)C2)CCCNC1
InChIInChI=1S/C15H31N3/c1-4-15(7-5-8-16-12-15)13-18(3)11-14-6-9-17(2)10-14/h14,16H,4-13H2,1-3H3
InChIKeyCTPCKGNRHWNJQU-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.65
Rot. Bonds5

About N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine

N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine (PubChem CID 63274170) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound NameN-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine
PubChem CID63274170
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine
SMILESCCC1(CN(C)CC2CCN(C)C2)CCCNC1
InChIInChI=1S/C15H31N3/c1-4-15(7-5-8-16-12-15)13-18(3)11-14-6-9-17(2)10-14/h14,16H,4-13H2,1-3H3
InChIKeyCTPCKGNRHWNJQU-UHFFFAOYSA-N
XLogP1.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-(1-methylpiperidin-4-yl)methanamine
CID 83074027
N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride
CID 120898710
[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol
CID 115247057
1-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopropan-1-amine
CID 65460030
[3-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]oxan-3-yl]methanol
CID 63745746
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-1-(1-methylpiperidin-3-yl)methanamine
CID 115244261
N-[(3-ethylpiperidin-3-yl)methyl]-2,2,2-trifluoro-N-methylethanamine
CID 63132920
N-ethyl-N-[(3-ethylpiperidin-3-yl)methyl]cyclopropanamine
CID 63133416
N-[[3-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]oxan-3-yl]methyl]propan-1-amine
CID 63740701
1-cyclopropyl-N-[(3-ethylpiperidin-3-yl)methyl]-N-methylethanamine
CID 63133014
[1-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclopropyl]methanol
CID 115243609
2-(1,4-diazepan-1-yl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]ethanamine
CID 63274337

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine?
The IUPAC name of N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine (CID 63274170) is N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine?
The canonical SMILES for N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine is CCC1(CN(C)CC2CCN(C)C2)CCCNC1.
What is the InChIKey of N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine?
The InChIKey is CTPCKGNRHWNJQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-4-15(7-5-8-16-12-15)13-18(3)11-14-6-9-17(2)10-14/h14,16H,4-13H2,1-3H3.
What are the key properties of N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine?
N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine has a molecular weight of 253.43 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 63274170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).