N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine

C14H24N4O — CID 66319701

IUPACN-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine
SMILESCCOc1cc(N(CC)C2CCCC2CN)ncn1
InChIInChI=1S/C14H24N4O/c1-3-18(12-7-5-6-11(12)9-15)13-8-14(19-4-2)17-10-16-13/h8,10-12H,3-7,9,15H2,1-2H3
InChIKeyBXDZJNKBHSWAPM-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.83
Rot. Bonds6

About N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine

N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine (PubChem CID 66319701) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine
PubChem CID66319701
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine
SMILESCCOc1cc(N(CC)C2CCCC2CN)ncn1
InChIInChI=1S/C14H24N4O/c1-3-18(12-7-5-6-11(12)9-15)13-8-14(19-4-2)17-10-16-13/h8,10-12H,3-7,9,15H2,1-2H3
InChIKeyBXDZJNKBHSWAPM-UHFFFAOYSA-N
XLogP1.83
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine (CID 66319701) is N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine is CCOc1cc(N(CC)C2CCCC2CN)ncn1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine?
The InChIKey is BXDZJNKBHSWAPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-18(12-7-5-6-11(12)9-15)13-8-14(19-4-2)17-10-16-13/h8,10-12H,3-7,9,15H2,1-2H3.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine?
N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-6-ethoxy-N-ethylpyrimidin-4-amine is sourced from PubChem (CID 66319701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).