N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine

C10H18N4 — CID 103568795

IUPACN-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine
SMILESCn1cc(NCC2(CN)CCC2)cn1
InChIInChI=1S/C10H18N4/c1-14-6-9(5-13-14)12-8-10(7-11)3-2-4-10/h5-6,12H,2-4,7-8,11H2,1H3
InChIKeyDPLNAAJQJNUNRZ-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.96
Rot. Bonds4

About N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine

N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine (PubChem CID 103568795) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine
PubChem CID103568795
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine
SMILESCn1cc(NCC2(CN)CCC2)cn1
InChIInChI=1S/C10H18N4/c1-14-6-9(5-13-14)12-8-10(7-11)3-2-4-10/h5-6,12H,2-4,7-8,11H2,1H3
InChIKeyDPLNAAJQJNUNRZ-UHFFFAOYSA-N
XLogP0.96
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(diethylamino)ethyl]-1H-pyrazol-4-amine
CID 42281880
N-ethyl-1-methyl-1H-pyrazol-4-amine
CID 43534862
1-(2,2-dimethylpropyl)-1H-pyrazol-4-amine
CID 51000375
1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine
CID 54593547
1-cyclobutyl-1H-pyrazol-4-amine
CID 55284978
1-(1-methyl-1H-pyrazol-4-yl)piperazine
CID 56828582
1-(1-cyclopropylethyl)-1H-pyrazol-4-amine
CID 61272898
N-methyl-1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine
CID 64270757
1-(cyclobutylmethyl)-1H-pyrazol-4-amine
CID 64985324
1-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-4-amine
CID 67113476
1-(1-methylpiperidin-4-yl)-1H-pyrazol-4-amine hydrochloride
CID 89717616
1-tert-butyl-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidin-4-amine
CID 75447215

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine (CID 103568795) is N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine is Cn1cc(NCC2(CN)CCC2)cn1.
What is the InChIKey of N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine?
The InChIKey is DPLNAAJQJNUNRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-14-6-9(5-13-14)12-8-10(7-11)3-2-4-10/h5-6,12H,2-4,7-8,11H2,1H3.
What are the key properties of N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine?
N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine has a molecular weight of 194.28 g/mol, XLogP of 0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylpyrazol-4-amine is sourced from PubChem (CID 103568795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).