N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide

C15H30N4O2 — CID 106615591

IUPACN-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide
SMILESCCCN(CC(=O)NC(=O)NCC(C)C)CC1CCCN1
InChIInChI=1S/C15H30N4O2/c1-4-8-19(10-13-6-5-7-16-13)11-14(20)18-15(21)17-9-12(2)3/h12-13,16H,4-11H2,1-3H3,(H2,17,18,20,21)
InChIKeyOJPIQBHHNWSPOO-UHFFFAOYSA-N
MW298.43 g/mol
LogP0.93
Rot. Bonds8

About N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide

N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide (PubChem CID 106615591) has the molecular formula C15H30N4O2 and a molecular weight of 298.43 g/mol. Its IUPAC name is N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide
PubChem CID106615591
Molecular FormulaC15H30N4O2
Molecular Weight298.43 g/mol
Exact Mass298.24
IUPAC NameN-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide
SMILESCCCN(CC(=O)NC(=O)NCC(C)C)CC1CCCN1
InChIInChI=1S/C15H30N4O2/c1-4-8-19(10-13-6-5-7-16-13)11-14(20)18-15(21)17-9-12(2)3/h12-13,16H,4-11H2,1-3H3,(H2,17,18,20,21)
InChIKeyOJPIQBHHNWSPOO-UHFFFAOYSA-N
XLogP0.93
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(ethylcarbamoyl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106636038
2-[piperidin-2-ylmethyl(propyl)amino]-N-(propylcarbamoyl)acetamide
CID 106635938
2-[butyl(pyrrolidin-2-ylmethyl)amino]-N-(ethylcarbamoyl)acetamide
CID 106616837
2-[ethyl(pyrrolidin-2-ylmethyl)amino]-N-(2-methylpropyl)acetamide
CID 106615127
2-[piperidin-2-ylmethyl(propyl)amino]-N-propylacetamide
CID 106636145
N-tert-butyl-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106616037
N-(ethylcarbamoyl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614699
2-[propyl(pyrrolidin-2-ylmethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 106615942
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N-(prop-2-enylcarbamoyl)acetamide
CID 106618204
2-[butyl(pyrrolidin-2-ylmethyl)amino]-N-methylacetamide
CID 106616577
N-(tert-butylcarbamoyl)-2-[ethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106615007
N-(2-cyanoethyl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106636144

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide (CID 106615591) is N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide is CCCN(CC(=O)NC(=O)NCC(C)C)CC1CCCN1.
What is the InChIKey of N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The InChIKey is OJPIQBHHNWSPOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O2/c1-4-8-19(10-13-6-5-7-16-13)11-14(20)18-15(21)17-9-12(2)3/h12-13,16H,4-11H2,1-3H3,(H2,17,18,20,21).
What are the key properties of N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide?
N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide has a molecular weight of 298.43 g/mol, XLogP of 0.93, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropylcarbamoyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 106615591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).