N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride

C12H20ClN3 — CID 71641683

IUPACN-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride
SMILESCN(Cc1ccncc1)C1CCNCC1.Cl
InChIInChI=1S/C12H19N3.ClH/c1-15(12-4-8-14-9-5-12)10-11-2-6-13-7-3-11;/h2-3,6-7,12,14H,4-5,8-10H2,1H3;1H
InChIKeyWSHSCSLLGYUESV-UHFFFAOYSA-N
MW241.77 g/mol
LogP1.69
Rot. Bonds3

About N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride

N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride (PubChem CID 71641683) has the molecular formula C12H20ClN3 and a molecular weight of 241.77 g/mol. Its IUPAC name is N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride
PubChem CID71641683
Molecular FormulaC12H20ClN3
Molecular Weight241.77 g/mol
Exact Mass241.13
IUPAC NameN-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride
SMILESCN(Cc1ccncc1)C1CCNCC1.Cl
InChIInChI=1S/C12H19N3.ClH/c1-15(12-4-8-14-9-5-12)10-11-2-6-13-7-3-11;/h2-3,6-7,12,14H,4-5,8-10H2,1H3;1H
InChIKeyWSHSCSLLGYUESV-UHFFFAOYSA-N
XLogP1.69
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.77
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(pyridin-4-ylmethyl)azetidin-3-amine
CID 62786509
N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
CID 43607110
N,2,2-trimethyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
CID 115145554
N-methyl-N-piperidin-4-yl-1-pyridin-4-ylmethanesulfonamide
CID 71641545
N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide
CID 43602089
N-[[4-(difluoromethyl)phenyl]methyl]-N-methylazepan-4-amine;hydrochloride
CID 120845420
N-benzyl-N-methylpyrrolidin-3-amine
CID 14834678
N-methyl-N-(quinolin-6-ylmethyl)piperidin-4-amine
CID 43607729
N-[(2-bromophenyl)methyl]-N-methylpiperidin-4-amine;hydrochloride
CID 119912776
N-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]piperidin-4-amine
CID 43607736
N-methyl-N-(pyridin-4-ylmethyl)spiro[4,5-dihydro-3H-1,4-benzoxazepine-2,4'-cyclohexane]-1'-amine
CID 92607607
N,N'-dimethyl-N,N'-di(piperidin-4-yl)ethane-1,2-diamine;tetrahydrochloride
CID 18770418

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride?
The IUPAC name of N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride (CID 71641683) is N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride.
What is the SMILES notation for N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride?
The canonical SMILES for N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride is CN(Cc1ccncc1)C1CCNCC1.Cl.
What is the InChIKey of N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride?
The InChIKey is WSHSCSLLGYUESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3.ClH/c1-15(12-4-8-14-9-5-12)10-11-2-6-13-7-3-11;/h2-3,6-7,12,14H,4-5,8-10H2,1H3;1H.
What are the key properties of N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride?
N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride has a molecular weight of 241.77 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride is sourced from PubChem (CID 71641683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).