N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride

C14H30ClN3 — CID 120898710

IUPACN-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride
SMILESCN1CCCC(CN(C)CC2(C)CCNC2)C1.Cl
InChIInChI=1S/C14H29N3.ClH/c1-14(6-7-15-11-14)12-17(3)10-13-5-4-8-16(2)9-13;/h13,15H,4-12H2,1-3H3;1H
InChIKeyQKKUHXBQYUKLQM-UHFFFAOYSA-N
MW275.87 g/mol
LogP1.68
Rot. Bonds4

About N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride

N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride (PubChem CID 120898710) has the molecular formula C14H30ClN3 and a molecular weight of 275.87 g/mol. Its IUPAC name is N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride
PubChem CID120898710
Molecular FormulaC14H30ClN3
Molecular Weight275.87 g/mol
Exact Mass275.21
IUPAC NameN-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride
SMILESCN1CCCC(CN(C)CC2(C)CCNC2)C1.Cl
InChIInChI=1S/C14H29N3.ClH/c1-14(6-7-15-11-14)12-17(3)10-13-5-4-8-16(2)9-13;/h13,15H,4-12H2,1-3H3;1H
InChIKeyQKKUHXBQYUKLQM-UHFFFAOYSA-N
XLogP1.68
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.87
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride?
The IUPAC name of N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride (CID 120898710) is N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride?
The canonical SMILES for N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride is CN1CCCC(CN(C)CC2(C)CCNC2)C1.Cl.
What is the InChIKey of N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride?
The InChIKey is QKKUHXBQYUKLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3.ClH/c1-14(6-7-15-11-14)12-17(3)10-13-5-4-8-16(2)9-13;/h13,15H,4-12H2,1-3H3;1H.
What are the key properties of N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride?
N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride has a molecular weight of 275.87 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride is sourced from PubChem (CID 120898710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).