4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide

C12H24N2O3 — CID 82948017

IUPAC4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide
SMILESCOCCN(C(=O)C1(N)CCOCC1)C(C)C
InChIInChI=1S/C12H24N2O3/c1-10(2)14(6-9-16-3)11(15)12(13)4-7-17-8-5-12/h10H,4-9,13H2,1-3H3
InChIKeyQUGRSFMQHPBESM-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.38
Rot. Bonds5

About 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide

4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide (PubChem CID 82948017) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide
PubChem CID82948017
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide
SMILESCOCCN(C(=O)C1(N)CCOCC1)C(C)C
InChIInChI=1S/C12H24N2O3/c1-10(2)14(6-9-16-3)11(15)12(13)4-7-17-8-5-12/h10H,4-9,13H2,1-3H3
InChIKeyQUGRSFMQHPBESM-UHFFFAOYSA-N
XLogP0.38
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(N'-hydroxycarbamimidoyl)-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide
CID 82961261
3-amino-N-propan-2-yl-N-propyloxolane-3-carboxamide
CID 64892499
4-amino-N-ethyl-N-(2-methoxyethyl)oxane-4-carboxamide
CID 115294699
4-amino-N-(2-amino-2-oxoethyl)-N-propan-2-yloxane-4-carboxamide
CID 115293731
2-[(4-aminooxane-4-carbonyl)-propan-2-ylamino]acetic acid
CID 113280683
4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide
CID 115294429
3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide
CID 64891152
1-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylcyclobutane-1-carboxamide
CID 82947993
1-amino-N-propan-2-yl-N-propylcyclopropane-1-carboxamide
CID 65466563
1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 54872120
4-amino-N-(2-methylpropyl)-N-pentan-3-yloxane-4-carboxamide
CID 115295136
4-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]oxane-4-carboxamide
CID 113280761

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide?
The IUPAC name of 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide (CID 82948017) is 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide.
What is the SMILES notation for 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide?
The canonical SMILES for 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide is COCCN(C(=O)C1(N)CCOCC1)C(C)C.
What is the InChIKey of 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide?
The InChIKey is QUGRSFMQHPBESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-10(2)14(6-9-16-3)11(15)12(13)4-7-17-8-5-12/h10H,4-9,13H2,1-3H3.
What are the key properties of 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide?
4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide has a molecular weight of 244.33 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide is sourced from PubChem (CID 82948017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).