1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine

C11H20N4 — CID 61210854

IUPAC1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine
SMILESCc1[nH]ncc1CNC1CCCN(C)C1
InChIInChI=1S/C11H20N4/c1-9-10(7-13-14-9)6-12-11-4-3-5-15(2)8-11/h7,11-12H,3-6,8H2,1-2H3,(H,13,14)
InChIKeyVEBBYJBCFWSKSU-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.90
Rot. Bonds3

About 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine

1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine (PubChem CID 61210854) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine
PubChem CID61210854
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine
SMILESCc1[nH]ncc1CNC1CCCN(C)C1
InChIInChI=1S/C11H20N4/c1-9-10(7-13-14-9)6-12-11-4-3-5-15(2)8-11/h7,11-12H,3-6,8H2,1-2H3,(H,13,14)
InChIKeyVEBBYJBCFWSKSU-UHFFFAOYSA-N
XLogP0.90
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-propan-2-ylazepan-4-amine
CID 65073424
1,2-dimethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-amine
CID 79032377
1-methyl-3-[(3S)-3-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidin-1-yl]pyrazin-2-one
CID 129344132
1-methyl-5-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidin-2-one
CID 64654324
1-(cyclohexylmethyl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-amine
CID 56821604
4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]cycloheptan-1-amine
CID 65079880
1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine
CID 114699054
4-[(5-methyl-1H-pyrazol-4-yl)methylamino]cyclohexan-1-ol
CID 43663529
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62703899
N-[(2,5-dimethylphenyl)methyl]-1-methylpiperidin-3-amine
CID 54971762
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 43747484
4-[(5-methyl-1H-pyrazol-4-yl)methylamino]azepan-2-one
CID 63887122

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine?
The IUPAC name of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine (CID 61210854) is 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine.
What is the SMILES notation for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine?
The canonical SMILES for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine is Cc1[nH]ncc1CNC1CCCN(C)C1.
What is the InChIKey of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine?
The InChIKey is VEBBYJBCFWSKSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-9-10(7-13-14-9)6-12-11-4-3-5-15(2)8-11/h7,11-12H,3-6,8H2,1-2H3,(H,13,14).
What are the key properties of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine?
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine has a molecular weight of 208.31 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine is sourced from PubChem (CID 61210854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).