N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide

C16H26N6O2 — CID 110244663

IUPACN-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(n2nnn(C3CC3)c2=O)CC1)NC1CCCC1
InChIInChI=1S/C16H26N6O2/c23-15(17-12-3-1-2-4-12)11-20-9-7-14(8-10-20)22-16(24)21(18-19-22)13-5-6-13/h12-14H,1-11H2,(H,17,23)
InChIKeyVBPBBPOZWUCCJX-UHFFFAOYSA-N
MW334.42 g/mol
LogP0.47
Rot. Bonds5

About N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide

N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide (PubChem CID 110244663) has the molecular formula C16H26N6O2 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide
PubChem CID110244663
Molecular FormulaC16H26N6O2
Molecular Weight334.42 g/mol
Exact Mass334.21
IUPAC NameN-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(n2nnn(C3CC3)c2=O)CC1)NC1CCCC1
InChIInChI=1S/C16H26N6O2/c23-15(17-12-3-1-2-4-12)11-20-9-7-14(8-10-20)22-16(24)21(18-19-22)13-5-6-13/h12-14H,1-11H2,(H,17,23)
InChIKeyVBPBBPOZWUCCJX-UHFFFAOYSA-N
XLogP0.47
TPSA85.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide (CID 110244663) is N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide is O=C(CN1CCC(n2nnn(C3CC3)c2=O)CC1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide?
The InChIKey is VBPBBPOZWUCCJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N6O2/c23-15(17-12-3-1-2-4-12)11-20-9-7-14(8-10-20)22-16(24)21(18-19-22)13-5-6-13/h12-14H,1-11H2,(H,17,23).
What are the key properties of N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide?
N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide has a molecular weight of 334.42 g/mol, XLogP of 0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[4-(4-cyclopropyl-5-oxotetrazol-1-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 110244663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).