N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine

C14H26N4 — CID 124751623

IUPACN-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine
SMILESC[C@@H]1CCCCN1CCN(C)CCc1cn[nH]c1
InChIInChI=1S/C14H26N4/c1-13-5-3-4-7-18(13)10-9-17(2)8-6-14-11-15-16-12-14/h11-13H,3-10H2,1-2H3,(H,15,16)/t13-/m1/s1
InChIKeyHEDIPLGJQCILGV-CYBMUJFWSA-N
MW250.39 g/mol
LogP1.76
Rot. Bonds6

About N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine

N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine (PubChem CID 124751623) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine
PubChem CID124751623
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine
SMILESC[C@@H]1CCCCN1CCN(C)CCc1cn[nH]c1
InChIInChI=1S/C14H26N4/c1-13-5-3-4-7-18(13)10-9-17(2)8-6-14-11-15-16-12-14/h11-13H,3-10H2,1-2H3,(H,15,16)/t13-/m1/s1
InChIKeyHEDIPLGJQCILGV-CYBMUJFWSA-N
XLogP1.76
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-(1-methylpiperidin-2-yl)-N-[2-(1H-pyrazol-4-yl)ethyl]propanamide
CID 50967172
N-methyl-2-[(2S)-2-methylpiperidin-1-yl]-N-[(3-methyl-4-pyridinyl)methyl]ethanamine
CID 124753653
N-methyl-2-[(2S)-2-methylpiperidin-1-yl]-N-[(4-propan-2-yl-1,2,4-triazol-3-yl)methyl]ethanamine
CID 124754878
N-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-2-(2-methylpiperidin-1-yl)ethanamine
CID 50952219
N-methyl-2-(2-methylpiperidin-1-yl)-N-[(3-methyl-1-prop-2-enylpyrazol-4-yl)methyl]ethanamine
CID 46984007
(2S)-2-methyl-4-(4-methylphenyl)-1-[2-(1H-pyrazol-4-yl)ethyl]piperazine
CID 124755196
N-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]thian-4-amine
CID 50983919
N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]thian-4-amine
CID 95147822
4-[4-(2-methylpiperidin-1-yl)butyl]phenol
CID 82187998
2-N,4-N-dimethyl-2-N-[2-(2-methylpiperidin-1-yl)ethyl]pyrimidine-2,4-diamine
CID 50963898
2-N,4-N-dimethyl-2-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]pyrimidine-2,4-diamine
CID 95127807
(1R,9S)-11-cycloheptyl-5-[[methyl-[2-(1H-pyrazol-4-yl)ethyl]amino]methyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
CID 176500565

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine?
The IUPAC name of N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine (CID 124751623) is N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine.
What is the SMILES notation for N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine?
The canonical SMILES for N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine is C[C@@H]1CCCCN1CCN(C)CCc1cn[nH]c1.
What is the InChIKey of N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine?
The InChIKey is HEDIPLGJQCILGV-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H26N4/c1-13-5-3-4-7-18(13)10-9-17(2)8-6-14-11-15-16-12-14/h11-13H,3-10H2,1-2H3,(H,15,16)/t13-/m1/s1.
What are the key properties of N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine?
N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine has a molecular weight of 250.39 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)ethanamine is sourced from PubChem (CID 124751623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).