N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide

C12H24N4O2 — CID 113408616

IUPACN-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
SMILESCCN(CC)C(=O)C(C)NC(=O)C1CNCCN1
InChIInChI=1S/C12H24N4O2/c1-4-16(5-2)12(18)9(3)15-11(17)10-8-13-6-7-14-10/h9-10,13-14H,4-8H2,1-3H3,(H,15,17)
InChIKeyNSTYCWRQUUVJOL-UHFFFAOYSA-N
MW256.35 g/mol
LogP-1.08
Rot. Bonds5

About N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide

N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide (PubChem CID 113408616) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
PubChem CID113408616
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC NameN-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
SMILESCCN(CC)C(=O)C(C)NC(=O)C1CNCCN1
InChIInChI=1S/C12H24N4O2/c1-4-16(5-2)12(18)9(3)15-11(17)10-8-13-6-7-14-10/h9-10,13-14H,4-8H2,1-3H3,(H,15,17)
InChIKeyNSTYCWRQUUVJOL-UHFFFAOYSA-N
XLogP-1.08
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-1.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(ethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
CID 63103460
N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
CID 167160475
2-[[1-(diethylamino)-1-oxopropan-2-yl]carbamoyl]cyclopropane-1-carboxylic acid
CID 54868358
5-[[1-(diethylamino)-1-oxopropan-2-yl]carbamoyl]oxolane-2-carboxylic acid
CID 102688026
N-(3-methylpentan-3-yl)piperazine-2-carboxamide
CID 106329297
3-[[1-(diethylamino)-1-oxopropan-2-yl]carbamoyl]cyclopentane-1-carboxylic acid
CID 103550244
N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]azetidine-3-carboxamide
CID 103109047
N-(2,2-dimethylpropyl)piperazine-2-carboxamide
CID 63103456
ethyl 2-(piperazine-2-carbonylamino)acetate
CID 54250774
methyl N-[1-(diethylamino)-1-oxopropan-2-yl]carbamate
CID 115590943
2-(cyclopropylamino)-N,N-diethylpropanamide
CID 43113043
5-amino-N-[1-(diethylamino)-1-oxopropan-2-yl]-2,4-dimethylcyclohexane-1-carboxamide
CID 102706894

Frequently Asked Questions

What is the IUPAC name of N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
The IUPAC name of N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide (CID 113408616) is N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide.
What is the SMILES notation for N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
The canonical SMILES for N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide is CCN(CC)C(=O)C(C)NC(=O)C1CNCCN1.
What is the InChIKey of N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
The InChIKey is NSTYCWRQUUVJOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-4-16(5-2)12(18)9(3)15-11(17)10-8-13-6-7-14-10/h9-10,13-14H,4-8H2,1-3H3,(H,15,17).
What are the key properties of N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide has a molecular weight of 256.35 g/mol, XLogP of -1.08, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide is sourced from PubChem (CID 113408616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).