N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine

C11H23N3 — CID 21483371

IUPACN,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine
SMILESCCN(CC)C(C)(C)C1=NCCCN1
InChIInChI=1S/C11H23N3/c1-5-14(6-2)11(3,4)10-12-8-7-9-13-10/h5-9H2,1-4H3,(H,12,13)
InChIKeyFPWCZEKMJCQFAQ-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.50
Rot. Bonds4

About N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine

N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine (PubChem CID 21483371) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine.

Molecular Properties

Compound NameN,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine
PubChem CID21483371
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine
SMILESCCN(CC)C(C)(C)C1=NCCCN1
InChIInChI=1S/C11H23N3/c1-5-14(6-2)11(3,4)10-12-8-7-9-13-10/h5-9H2,1-4H3,(H,12,13)
InChIKeyFPWCZEKMJCQFAQ-UHFFFAOYSA-N
XLogP1.50
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
The IUPAC name of N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine (CID 21483371) is N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine.
What is the SMILES notation for N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
The canonical SMILES for N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine is CCN(CC)C(C)(C)C1=NCCCN1.
What is the InChIKey of N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
The InChIKey is FPWCZEKMJCQFAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-5-14(6-2)11(3,4)10-12-8-7-9-13-10/h5-9H2,1-4H3,(H,12,13).
What are the key properties of N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine has a molecular weight of 197.33 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine is sourced from PubChem (CID 21483371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).