2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine

C17H37N3 — CID 83054308

IUPAC2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCCCC(CNCC(C)C)N1CCN(C(C)CC)CC1
InChIInChI=1S/C17H37N3/c1-6-8-17(14-18-13-15(3)4)20-11-9-19(10-12-20)16(5)7-2/h15-18H,6-14H2,1-5H3
InChIKeyHYRLPEYVJKBSNY-UHFFFAOYSA-N
MW283.50 g/mol
LogP2.82
Rot. Bonds9

About 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine

2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine (PubChem CID 83054308) has the molecular formula C17H37N3 and a molecular weight of 283.50 g/mol. Its IUPAC name is 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound Name2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine
PubChem CID83054308
Molecular FormulaC17H37N3
Molecular Weight283.50 g/mol
Exact Mass283.30
IUPAC Name2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCCCC(CNCC(C)C)N1CCN(C(C)CC)CC1
InChIInChI=1S/C17H37N3/c1-6-8-17(14-18-13-15(3)4)20-11-9-19(10-12-20)16(5)7-2/h15-18H,6-14H2,1-5H3
InChIKeyHYRLPEYVJKBSNY-UHFFFAOYSA-N
XLogP2.82
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-2-morpholin-4-ylpentan-1-amine
CID 83042710
N-[2-(4-butan-2-ylpiperazin-1-yl)propyl]-3-methylbutan-1-amine
CID 62773868
N-(2-methylpropyl)-2-(3,4,5-trimethylpiperazin-1-yl)pentan-1-amine
CID 114540171
2-(azepan-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62437423
5-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62774852
2-(3-methoxy-4-methylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 102967967
N-methyl-2-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 83054458
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-methylpropyl)pentan-1-amine
CID 83042402
2-(4-tert-butylpiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 55194853
N-(2-methylpropyl)-2-(1,4-oxazepan-4-yl)butan-1-amine
CID 62972860
2-(4-butan-2-ylpiperazin-1-yl)-4-methylpentan-1-amine
CID 55117502
2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine
CID 62773305

Frequently Asked Questions

What is the IUPAC name of 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The IUPAC name of 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine (CID 83054308) is 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine is CCCC(CNCC(C)C)N1CCN(C(C)CC)CC1.
What is the InChIKey of 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The InChIKey is HYRLPEYVJKBSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37N3/c1-6-8-17(14-18-13-15(3)4)20-11-9-19(10-12-20)16(5)7-2/h15-18H,6-14H2,1-5H3.
What are the key properties of 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine has a molecular weight of 283.50 g/mol, XLogP of 2.82, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 83054308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).