2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine

C8H15N3 — CID 62403356

IUPAC2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine
SMILESCC(C)(C)NCc1cn[nH]c1
InChIInChI=1S/C8H15N3/c1-8(2,3)9-4-7-5-10-11-6-7/h5-6,9H,4H2,1-3H3,(H,10,11)
InChIKeyQRXZJPOGTWUXQN-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.30
Rot. Bonds2

About 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine

2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine (PubChem CID 62403356) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine
PubChem CID62403356
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine
SMILESCC(C)(C)NCc1cn[nH]c1
InChIInChI=1S/C8H15N3/c1-8(2,3)9-4-7-5-10-11-6-7/h5-6,9H,4H2,1-3H3,(H,10,11)
InChIKeyQRXZJPOGTWUXQN-UHFFFAOYSA-N
XLogP1.30
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine?
The IUPAC name of 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine (CID 62403356) is 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine.
What is the SMILES notation for 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine?
The canonical SMILES for 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine is CC(C)(C)NCc1cn[nH]c1.
What is the InChIKey of 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine?
The InChIKey is QRXZJPOGTWUXQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-8(2,3)9-4-7-5-10-11-6-7/h5-6,9H,4H2,1-3H3,(H,10,11).
What are the key properties of 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine?
2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine has a molecular weight of 153.23 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1H-pyrazol-4-ylmethyl)propan-2-amine is sourced from PubChem (CID 62403356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).