N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide

C19H29N5O — CID 72895405

IUPACN-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide
SMILESCCC(NC(=O)CC1CCN(C(C)C)CC1)c1cn2cccnc2n1
InChIInChI=1S/C19H29N5O/c1-4-16(17-13-24-9-5-8-20-19(24)22-17)21-18(25)12-15-6-10-23(11-7-15)14(2)3/h5,8-9,13-16H,4,6-7,10-12H2,1-3H3,(H,21,25)
InChIKeyOICRHEKXCLLBPD-UHFFFAOYSA-N
MW343.48 g/mol
LogP2.81
Rot. Bonds6

About N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide

N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide (PubChem CID 72895405) has the molecular formula C19H29N5O and a molecular weight of 343.48 g/mol. Its IUPAC name is N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide
PubChem CID72895405
Molecular FormulaC19H29N5O
Molecular Weight343.48 g/mol
Exact Mass343.24
IUPAC NameN-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide
SMILESCCC(NC(=O)CC1CCN(C(C)C)CC1)c1cn2cccnc2n1
InChIInChI=1S/C19H29N5O/c1-4-16(17-13-24-9-5-8-20-19(24)22-17)21-18(25)12-15-6-10-23(11-7-15)14(2)3/h5,8-9,13-16H,4,6-7,10-12H2,1-3H3,(H,21,25)
InChIKeyOICRHEKXCLLBPD-UHFFFAOYSA-N
XLogP2.81
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.48
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide?
The IUPAC name of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide (CID 72895405) is N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide is CCC(NC(=O)CC1CCN(C(C)C)CC1)c1cn2cccnc2n1.
What is the InChIKey of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide?
The InChIKey is OICRHEKXCLLBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O/c1-4-16(17-13-24-9-5-8-20-19(24)22-17)21-18(25)12-15-6-10-23(11-7-15)14(2)3/h5,8-9,13-16H,4,6-7,10-12H2,1-3H3,(H,21,25).
What are the key properties of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide?
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide has a molecular weight of 343.48 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(1-propan-2-ylpiperidin-4-yl)acetamide is sourced from PubChem (CID 72895405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).