5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine

C14H29N5 — CID 66017334

IUPAC5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NC(C)CN(CC)CC)c1N
InChIInChI=1S/C14H29N5/c1-6-9-12-13(15)14(18(5)17-12)16-11(4)10-19(7-2)8-3/h11,16H,6-10,15H2,1-5H3
InChIKeyWTLXIDIQBMUVOE-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.10
Rot. Bonds8

About 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine

5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine (PubChem CID 66017334) has the molecular formula C14H29N5 and a molecular weight of 267.42 g/mol. Its IUPAC name is 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine
PubChem CID66017334
Molecular FormulaC14H29N5
Molecular Weight267.42 g/mol
Exact Mass267.24
IUPAC Name5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NC(C)CN(CC)CC)c1N
InChIInChI=1S/C14H29N5/c1-6-9-12-13(15)14(18(5)17-12)16-11(4)10-19(7-2)8-3/h11,16H,6-10,15H2,1-5H3
InChIKeyWTLXIDIQBMUVOE-UHFFFAOYSA-N
XLogP2.10
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine?
The IUPAC name of 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine (CID 66017334) is 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine is CCCc1nn(C)c(NC(C)CN(CC)CC)c1N.
What is the InChIKey of 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine?
The InChIKey is WTLXIDIQBMUVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N5/c1-6-9-12-13(15)14(18(5)17-12)16-11(4)10-19(7-2)8-3/h11,16H,6-10,15H2,1-5H3.
What are the key properties of 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine?
5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine has a molecular weight of 267.42 g/mol, XLogP of 2.10, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine is sourced from PubChem (CID 66017334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).