N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine

C13H27N3 — CID 156720132

IUPACN-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine
SMILESCNCC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C13H27N3/c1-14-10-12-4-8-16(9-5-12)11-13-2-6-15-7-3-13/h12-15H,2-11H2,1H3
InChIKeyVHTKJCJJMRIARM-UHFFFAOYSA-N
MW225.38 g/mol
LogP0.92
Rot. Bonds4

About N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine

N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine (PubChem CID 156720132) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine
PubChem CID156720132
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC NameN-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine
SMILESCNCC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C13H27N3/c1-14-10-12-4-8-16(9-5-12)11-13-2-6-15-7-3-13/h12-15H,2-11H2,1H3
InChIKeyVHTKJCJJMRIARM-UHFFFAOYSA-N
XLogP0.92
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine
CID 144757867
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
1-[1-(cyclopropylmethyl)pyrrolidin-3-yl]-N-methylmethanamine
CID 62511549
1-[1-(aminomethyl)piperidin-4-yl]-N-methylmethanamine
CID 146320414
N-methyl-3-[4-(piperidin-4-ylmethyl)piperazin-1-yl]propan-1-amine
CID 177055250
1-[1-(cyclobutylmethyl)pyrrolidin-3-yl]-N-methylmethanamine
CID 62511607
1-ethyl-4-[(4-piperidin-4-ylpiperidin-1-yl)methyl]piperidine
CID 167091278
4-(3-methylbutyl)-1-(piperidin-4-ylmethyl)piperidine;hydrochloride
CID 119932466
[1-(piperidin-4-ylmethyl)pyrrolidin-3-yl]methanol
CID 112629419
1-[1-[(4-ethylcyclohexyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine
CID 62513783
4-cyclohexyloxy-1-(piperidin-4-ylmethyl)piperidine
CID 119931133

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine (CID 156720132) is N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine is CNCC1CCN(CC2CCNCC2)CC1.
What is the InChIKey of N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine?
The InChIKey is VHTKJCJJMRIARM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-14-10-12-4-8-16(9-5-12)11-13-2-6-15-7-3-13/h12-15H,2-11H2,1H3.
What are the key properties of N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine?
N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine has a molecular weight of 225.38 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine is sourced from PubChem (CID 156720132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).