2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine

C12H21N3O — CID 115921784

IUPAC2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine
SMILESCCOCC(C)Nc1ccnn1CC1CC1
InChIInChI=1S/C12H21N3O/c1-3-16-9-10(2)14-12-6-7-13-15(12)8-11-4-5-11/h6-7,10-11,14H,3-5,8-9H2,1-2H3
InChIKeyNVXJNNNQJMIOBV-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.13
Rot. Bonds7

About 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine

2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine (PubChem CID 115921784) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine
PubChem CID115921784
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine
SMILESCCOCC(C)Nc1ccnn1CC1CC1
InChIInChI=1S/C12H21N3O/c1-3-16-9-10(2)14-12-6-7-13-15(12)8-11-4-5-11/h6-7,10-11,14H,3-5,8-9H2,1-2H3
InChIKeyNVXJNNNQJMIOBV-UHFFFAOYSA-N
XLogP2.13
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-2-(cyclopropylmethyl)pyrazol-3-amine
CID 115921786
N-(1-ethoxypropan-2-yl)-2-propylpyrazol-3-amine
CID 115926039
2-(cyclopropylmethyl)-N-propan-2-ylpyrazol-3-amine
CID 115921793
5-chloro-2-(cyclobutylmethyl)-4-(1-ethoxypropan-2-ylamino)pyridazin-3-one
CID 114436339
N-cyclopentyl-2-(cyclopropylmethyl)pyrazol-3-amine
CID 115702987
N-(3-methylpentan-2-yl)-2-(2-methylpropyl)pyrazol-3-amine
CID 115927824
N-(1-methoxybutan-2-yl)-2-(2-methylpropyl)pyrazol-3-amine
CID 115927827
N-(5-methylhexan-2-yl)-2-propylpyrazol-3-amine
CID 115926056
5-bromo-1-(cyclopropylmethyl)pyrazole
CID 84776026
N-(1-ethoxypropan-2-yl)-4-pyrazol-1-ylaniline
CID 75483453
N-[(2R)-1-ethoxypropan-2-yl]-4-pyrazol-1-ylaniline
CID 97337940
N-[[2-(3-ethoxypropyl)pyrazol-3-yl]methyl]cyclopropanamine
CID 65178386

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine?
The IUPAC name of 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine (CID 115921784) is 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine.
What is the SMILES notation for 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine?
The canonical SMILES for 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine is CCOCC(C)Nc1ccnn1CC1CC1.
What is the InChIKey of 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine?
The InChIKey is NVXJNNNQJMIOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-3-16-9-10(2)14-12-6-7-13-15(12)8-11-4-5-11/h6-7,10-11,14H,3-5,8-9H2,1-2H3.
What are the key properties of 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine?
2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine has a molecular weight of 223.32 g/mol, XLogP of 2.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethyl)-N-(1-ethoxypropan-2-yl)pyrazol-3-amine is sourced from PubChem (CID 115921784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).