N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide

C14H26N4O — CID 71846427

IUPACN-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide
SMILESCCN(C)C(=O)CCN(Cc1cnn(C)c1)C(C)C
InChIInChI=1S/C14H26N4O/c1-6-16(4)14(19)7-8-18(12(2)3)11-13-9-15-17(5)10-13/h9-10,12H,6-8,11H2,1-5H3
InChIKeyFYKDMAFZBRTULV-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.50
Rot. Bonds7

About N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide

N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide (PubChem CID 71846427) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide
PubChem CID71846427
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide
SMILESCCN(C)C(=O)CCN(Cc1cnn(C)c1)C(C)C
InChIInChI=1S/C14H26N4O/c1-6-16(4)14(19)7-8-18(12(2)3)11-13-9-15-17(5)10-13/h9-10,12H,6-8,11H2,1-5H3
InChIKeyFYKDMAFZBRTULV-UHFFFAOYSA-N
XLogP1.50
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide?
The IUPAC name of N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide (CID 71846427) is N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide.
What is the SMILES notation for N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide?
The canonical SMILES for N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide is CCN(C)C(=O)CCN(Cc1cnn(C)c1)C(C)C.
What is the InChIKey of N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide?
The InChIKey is FYKDMAFZBRTULV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-6-16(4)14(19)7-8-18(12(2)3)11-13-9-15-17(5)10-13/h9-10,12H,6-8,11H2,1-5H3.
What are the key properties of N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide?
N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide has a molecular weight of 266.39 g/mol, XLogP of 1.50, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-3-[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]propanamide is sourced from PubChem (CID 71846427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).