5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine

C14H27N5 — CID 66029704

IUPAC5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine
SMILESCc1nn(C(C)C)c(N2CCCC2CN(C)C)c1N
InChIInChI=1S/C14H27N5/c1-10(2)19-14(13(15)11(3)16-19)18-8-6-7-12(18)9-17(4)5/h10,12H,6-9,15H2,1-5H3
InChIKeyQFICVTNEBVDBJZ-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.89
Rot. Bonds4

About 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine

5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine (PubChem CID 66029704) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine.

Molecular Properties

Compound Name5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine
PubChem CID66029704
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine
SMILESCc1nn(C(C)C)c(N2CCCC2CN(C)C)c1N
InChIInChI=1S/C14H27N5/c1-10(2)19-14(13(15)11(3)16-19)18-8-6-7-12(18)9-17(4)5/h10,12H,6-9,15H2,1-5H3
InChIKeyQFICVTNEBVDBJZ-UHFFFAOYSA-N
XLogP1.89
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine?
The IUPAC name of 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine (CID 66029704) is 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine.
What is the SMILES notation for 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine?
The canonical SMILES for 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine is Cc1nn(C(C)C)c(N2CCCC2CN(C)C)c1N.
What is the InChIKey of 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine?
The InChIKey is QFICVTNEBVDBJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-10(2)19-14(13(15)11(3)16-19)18-8-6-7-12(18)9-17(4)5/h10,12H,6-9,15H2,1-5H3.
What are the key properties of 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine?
5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine has a molecular weight of 265.40 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine is sourced from PubChem (CID 66029704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).